N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide

C80H155N11O4 — CID 163997746

IUPACN-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide
SMILESC.C.C=C(C)N1CC2(CC(NC(C)(C)C)C2)C1.C=C1CCC2(CCN(C(C)C)CC2)N1.CC(=O)C1CC(CC(C)(C)C)C1.CC(=O)N1CC2(C1)CN(C(C)(C)C)C2.CC(=O)NC1CC2(C1)CN(C(C)C)C2.CC(=O)NC1CCCN(C(C)(C)C)CC1.CC1CN(C(C)(C)C)C1
InChIInChI=1S/C13H24N2.C12H24N2O.C12H22N2.2C11H20N2O.C11H20O.C8H17N.2CH4/c1-10(2)15-8-13(9-15)6-11(7-13)14-12(3,4)5;1-10(15)13-11-6-5-8-14(9-7-11)12(2,3)4;1-10(2)14-8-6-12(7-9-14)5-4-11(3)13-12;1-9(14)12-5-11(6-12)7-13(8-11)10(2,3)4;1-8(2)13-6-11(7-13)4-10(5-11)12-9(3)14;1-8(12)10-5-9(6-10)7-11(2,3)4;1-7-5-9(6-7)8(2,3)4;;/h11,14H,1,6-9H2,2-5H3;11H,5-9H2,1-4H3,(H,13,15);10,13H,3-9H2,1-2H3;5-8H2,1-4H3;8,10H,4-7H2,1-3H3,(H,12,14);9-10H,5-7H2,1-4H3;7H,5-6H2,1-4H3;2*1H4
InChIKeyUGEWROZXUZIWSR-UHFFFAOYSA-N
MW1335.19 g/mol
LogP14.27
Rot. Bonds8

About N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide

N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide (PubChem CID 163997746) has the molecular formula C80H155N11O4 and a molecular weight of 1335.19 g/mol. Its IUPAC name is N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide.

Molecular Properties

Compound NameN-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide
PubChem CID163997746
Molecular FormulaC80H155N11O4
Molecular Weight1335.19 g/mol
Exact Mass1334.23
IUPAC NameN-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide
SMILESC.C.C=C(C)N1CC2(CC(NC(C)(C)C)C2)C1.C=C1CCC2(CCN(C(C)C)CC2)N1.CC(=O)C1CC(CC(C)(C)C)C1.CC(=O)N1CC2(C1)CN(C(C)(C)C)C2.CC(=O)NC1CC2(C1)CN(C(C)C)C2.CC(=O)NC1CCCN(C(C)(C)C)CC1.CC1CN(C(C)(C)C)C1
InChIInChI=1S/C13H24N2.C12H24N2O.C12H22N2.2C11H20N2O.C11H20O.C8H17N.2CH4/c1-10(2)15-8-13(9-15)6-11(7-13)14-12(3,4)5;1-10(15)13-11-6-5-8-14(9-7-11)12(2,3)4;1-10(2)14-8-6-12(7-9-14)5-4-11(3)13-12;1-9(14)12-5-11(6-12)7-13(8-11)10(2,3)4;1-8(2)13-6-11(7-13)4-10(5-11)12-9(3)14;1-8(12)10-5-9(6-10)7-11(2,3)4;1-7-5-9(6-7)8(2,3)4;;/h11,14H,1,6-9H2,2-5H3;11H,5-9H2,1-4H3,(H,13,15);10,13H,3-9H2,1-2H3;5-8H2,1-4H3;8,10H,4-7H2,1-3H3,(H,12,14);9-10H,5-7H2,1-4H3;7H,5-6H2,1-4H3;2*1H4
InChIKeyUGEWROZXUZIWSR-UHFFFAOYSA-N
XLogP14.27
TPSA139.08 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds8
Heavy Atoms95
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001335.19
LogP ≤ 514.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Analyze N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide with MolForge

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Related Compounds

N-[(3S)-1-tert-butylpiperidin-3-yl]acetamide
CID 58182173
1-tert-butyl-3-fluoro-3-methylazetidine;1-tert-butyl-3-methylazetidine;1-tert-butylpiperidine;1-tert-butylpyrrolidine
CID 159358501
methyl 4-(cyclohexylamino)-1-propan-2-ylpiperidine-4-carboxylate
CID 60999032
1-tert-butylazetidine;1-tert-butyl-3-fluoro-3-methylazetidine;1-tert-butyl-4-fluoro-4-methylpiperidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;1-tert-butyl-3-methylazetidine;bis(1-tert-butyl-4-methylpiperidine);bis(1-tert-butyl-3-methylpyrrolidine);(3S)-1-tert-butyl-3-methylpyrrolidine;tris(1-tert-butylpiperidine);1-tert-butylpyrrolidine;1-ethylpiperazin-2-one;3-fluoro-3-methylpiperidine;2-methylidenepiperazine;1-methyl-2-methylidenepiperazine;3-methylpiperidine;pentakis(2-methylpropane);3-methyl-1-propan-2-ylpiperidine
CID 158169365
cyclohexanamine;N-[4-(4-propan-2-ylpiperazin-1-yl)cyclohexyl]acetamide
CID 68573955
N-(1-acetylpiperidin-4-yl)acetamide
CID 23402928
2-(4-acetylpiperazin-1-yl)-N-cyclopentylpropanamide
CID 123939055
1-[3-(tert-butylamino)pyrrolidin-1-yl]ethanone
CID 58945224
5-tert-butyl-2-[(1-tert-butylpiperidin-4-yl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole;2-tert-butyl-8-propan-2-yl-2,8-diazaspiro[4.5]decane
CID 167617800
1-(6-propan-2-yl-2,6-diazaspiro[3.3]heptan-2-yl)-2-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177010419
2-tert-butyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridine;6-tert-butyl-1,2,3,3a,4,5,7,7a-octahydropyrrolo[2,3-c]pyridine;tert-butylcyclohexane;8-tert-butyl-1,8-diazaspiro[4.5]decane;8-tert-butyl-2,8-diazaspiro[4.5]decane;2-tert-butyl-1,1-difluorocyclohexane;1-tert-butyl-3-methylpiperidine;3-tert-butyl-9-oxa-3,7-diazabicyclo[3.3.1]nonane;1-tert-butylpiperidin-4-amine;methane;5-propan-2-yl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole;N-propan-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-amine;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydropyrrolo[3,4-c]pyridine;2-propan-2-yl-3,3a,4,5,6,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;6-propan-2-yl-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine;2-propan-2-yl-2-azaspiro[4.5]decane;N-propan-2-ylcyclohexanamine;2-propan-2-yl-2,7-diazaspiro[4.4]nonane;N-propan-2-ylpiperidin-4-amine
CID 159438062
1-tert-butyl-N-methylpiperidin-4-amine;1-tert-butylpiperidin-4-amine;1-tert-butylpiperidine;1-N'-(1-tert-butylpiperidin-4-yl)ethene-1,1-diamine;methane;1-N'-methyl-1-N'-(1-propan-2-ylpiperidin-4-yl)ethene-1,1-diamine;N,N,2-trimethylpropan-2-amine
CID 165102019

Frequently Asked Questions

What is the IUPAC name of N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide?
The IUPAC name of N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide (CID 163997746) is N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide.
What is the SMILES notation for N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide?
The canonical SMILES for N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide is C.C.C=C(C)N1CC2(CC(NC(C)(C)C)C2)C1.C=C1CCC2(CCN(C(C)C)CC2)N1.CC(=O)C1CC(CC(C)(C)C)C1.CC(=O)N1CC2(C1)CN(C(C)(C)C)C2.CC(=O)NC1CC2(C1)CN(C(C)C)C2.CC(=O)NC1CCCN(C(C)(C)C)CC1.CC1CN(C(C)(C)C)C1.
What is the InChIKey of N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide?
The InChIKey is UGEWROZXUZIWSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2.C12H24N2O.C12H22N2.2C11H20N2O.C11H20O.C8H17N.2CH4/c1-10(2)15-8-13(9-15)6-11(7-13)14-12(3,4)5;1-10(15)13-11-6-5-8-14(9-7-11)12(2,3)4;1-10(2)14-8-6-12(7-9-14)5-4-11(3)13-12;1-9(14)12-5-11(6-12)7-13(8-11)10(2,3)4;1-8(2)13-6-11(7-13)4-10(5-11)12-9(3)14;1-8(12)10-5-9(6-10)7-11(2,3)4;1-7-5-9(6-7)8(2,3)4;;/h11,14H,1,6-9H2,2-5H3;11H,5-9H2,1-4H3,(H,13,15);10,13H,3-9H2,1-2H3;5-8H2,1-4H3;8,10H,4-7H2,1-3H3,(H,12,14);9-10H,5-7H2,1-4H3;7H,5-6H2,1-4H3;2*1H4.
What are the key properties of N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide?
N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide has a molecular weight of 1335.19 g/mol, XLogP of 14.27, 8 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-tert-butylazepan-4-yl)acetamide;1-(2-tert-butyl-2,6-diazaspiro[3.3]heptan-6-yl)ethanone;1-tert-butyl-3-methylazetidine;N-tert-butyl-2-prop-1-en-2-yl-2-azaspiro[3.3]heptan-6-amine;1-[3-(2,2-dimethylpropyl)cyclobutyl]ethanone;methane;2-methylidene-8-propan-2-yl-1,8-diazaspiro[4.5]decane;N-(2-propan-2-yl-2-azaspiro[3.3]heptan-6-yl)acetamide is sourced from PubChem (CID 163997746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).