N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine

C80H165N13 — CID 159679247

IUPACN,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine
SMILESCC(C)N1CC(CN(C)C)C1.CC(C)N1CC(N(C)C)C1.CC(C)N1CC2(CCC2)C1.CC(C)N1CC2(CCCCC2)C1.CC(C)N1CC2(CCCNC2)C1.CC(C)N1CC2(CCNC2)C1.CC1CN(C(C)C)C1.CCC1CN(C(C)C)C1.CCCC1CN(C(C)C)C1
InChIInChI=1S/C11H21N.C10H20N2.C9H18N2.C9H20N2.C9H17N.C9H19N.C8H18N2.C8H17N.C7H15N/c1-10(2)12-8-11(9-12)6-4-3-5-7-11;1-9(2)12-7-10(8-12)4-3-5-11-6-10;1-8(2)11-6-9(7-11)3-4-10-5-9;1-8(2)11-6-9(7-11)5-10(3)4;1-8(2)10-6-9(7-10)4-3-5-9;1-4-5-9-6-10(7-9)8(2)3;1-7(2)10-5-8(6-10)9(3)4;1-4-8-5-9(6-8)7(2)3;1-6(2)8-4-7(3)5-8/h10H,3-9H2,1-2H3;9,11H,3-8H2,1-2H3;8,10H,3-7H2,1-2H3;8-9H,5-7H2,1-4H3;8H,3-7H2,1-2H3;8-9H,4-7H2,1-3H3;7-8H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;6-7H,4-5H2,1-3H3
InChIKeyMUZVCCYRBXACKI-UHFFFAOYSA-N
MW1309.29 g/mol
LogP13.05
Rot. Bonds15

About N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine

N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine (PubChem CID 159679247) has the molecular formula C80H165N13 and a molecular weight of 1309.29 g/mol. Its IUPAC name is N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine.

Molecular Properties

Compound NameN,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine
PubChem CID159679247
Molecular FormulaC80H165N13
Molecular Weight1309.29 g/mol
Exact Mass1308.33
IUPAC NameN,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine
SMILESCC(C)N1CC(CN(C)C)C1.CC(C)N1CC(N(C)C)C1.CC(C)N1CC2(CCC2)C1.CC(C)N1CC2(CCCCC2)C1.CC(C)N1CC2(CCCNC2)C1.CC(C)N1CC2(CCNC2)C1.CC1CN(C(C)C)C1.CCC1CN(C(C)C)C1.CCCC1CN(C(C)C)C1
InChIInChI=1S/C11H21N.C10H20N2.C9H18N2.C9H20N2.C9H17N.C9H19N.C8H18N2.C8H17N.C7H15N/c1-10(2)12-8-11(9-12)6-4-3-5-7-11;1-9(2)12-7-10(8-12)4-3-5-11-6-10;1-8(2)11-6-9(7-11)3-4-10-5-9;1-8(2)11-6-9(7-11)5-10(3)4;1-8(2)10-6-9(7-10)4-3-5-9;1-4-5-9-6-10(7-9)8(2)3;1-7(2)10-5-8(6-10)9(3)4;1-4-8-5-9(6-8)7(2)3;1-6(2)8-4-7(3)5-8/h10H,3-9H2,1-2H3;9,11H,3-8H2,1-2H3;8,10H,3-7H2,1-2H3;8-9H,5-7H2,1-4H3;8H,3-7H2,1-2H3;8-9H,4-7H2,1-3H3;7-8H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;6-7H,4-5H2,1-3H3
InChIKeyMUZVCCYRBXACKI-UHFFFAOYSA-N
XLogP13.05
TPSA59.70 Ų
H-Bond Donors2
H-Bond Acceptors13
Rotatable Bonds15
Heavy Atoms93
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001309.29
LogP ≤ 513.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1013

Analyze N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine?
The IUPAC name of N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine (CID 159679247) is N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine.
What is the SMILES notation for N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine?
The canonical SMILES for N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine is CC(C)N1CC(CN(C)C)C1.CC(C)N1CC(N(C)C)C1.CC(C)N1CC2(CCC2)C1.CC(C)N1CC2(CCCCC2)C1.CC(C)N1CC2(CCCNC2)C1.CC(C)N1CC2(CCNC2)C1.CC1CN(C(C)C)C1.CCC1CN(C(C)C)C1.CCCC1CN(C(C)C)C1.
What is the InChIKey of N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine?
The InChIKey is MUZVCCYRBXACKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N.C10H20N2.C9H18N2.C9H20N2.C9H17N.C9H19N.C8H18N2.C8H17N.C7H15N/c1-10(2)12-8-11(9-12)6-4-3-5-7-11;1-9(2)12-7-10(8-12)4-3-5-11-6-10;1-8(2)11-6-9(7-11)3-4-10-5-9;1-8(2)11-6-9(7-11)5-10(3)4;1-8(2)10-6-9(7-10)4-3-5-9;1-4-5-9-6-10(7-9)8(2)3;1-7(2)10-5-8(6-10)9(3)4;1-4-8-5-9(6-8)7(2)3;1-6(2)8-4-7(3)5-8/h10H,3-9H2,1-2H3;9,11H,3-8H2,1-2H3;8,10H,3-7H2,1-2H3;8-9H,5-7H2,1-4H3;8H,3-7H2,1-2H3;8-9H,4-7H2,1-3H3;7-8H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;6-7H,4-5H2,1-3H3.
What are the key properties of N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine?
N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine has a molecular weight of 1309.29 g/mol, XLogP of 13.05, 15 rotatable bonds, 2 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-propan-2-ylazetidin-3-amine;N,N-dimethyl-1-(1-propan-2-ylazetidin-3-yl)methanamine;3-ethyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-propan-2-yl-2-azaspiro[3.3]heptane;2-propan-2-yl-2-azaspiro[3.5]nonane;2-propan-2-yl-2,8-diazaspiro[3.5]nonane;2-propan-2-yl-2,7-diazaspiro[3.4]octane;1-propan-2-yl-3-propylazetidine is sourced from PubChem (CID 159679247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).