N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine

C15H29N — CID 62712279

IUPACN-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine
SMILESCCC1CCC2(CC1)CC2CNCC(C)C
InChIInChI=1S/C15H29N/c1-4-13-5-7-15(8-6-13)9-14(15)11-16-10-12(2)3/h12-14,16H,4-11H2,1-3H3
InChIKeyYUUFMIIZEIXBGU-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.84
Rot. Bonds5

About N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine

N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine (PubChem CID 62712279) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine
PubChem CID62712279
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine
SMILESCCC1CCC2(CC1)CC2CNCC(C)C
InChIInChI=1S/C15H29N/c1-4-13-5-7-15(8-6-13)9-14(15)11-16-10-12(2)3/h12-14,16H,4-11H2,1-3H3
InChIKeyYUUFMIIZEIXBGU-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-N-(spiro[2.6]nonan-2-ylmethyl)propan-1-amine
CID 62714784
N-[(7-ethylspiro[2.6]nonan-2-yl)methyl]propan-1-amine
CID 65087341
N-[(6-ethyl-2,2-dimethylspiro[2.5]octan-1-yl)methyl]-2-methylpropan-1-amine
CID 114229867
N-[(6-ethylspiro[2.4]heptan-2-yl)methyl]propan-2-amine
CID 64516469
N-[(3-ethylcyclobutyl)methyl]-2-methylpropan-1-amine
CID 64999747
2-(bromomethyl)-6-ethylspiro[2.5]octane
CID 81351534
2-methyl-N-[(2-methyl-2-propylcyclopropyl)methyl]propan-1-amine
CID 62714427
N-[(5,5-dioxo-5λ6-thiaspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine
CID 63924260
2-methyl-N-[[2-methyl-2-(3-methylbutyl)cyclopropyl]methyl]propan-1-amine
CID 62713179
N-methyl-1-(6-propylspiro[2.5]octan-2-yl)methanamine
CID 62707974
N-[(7,7-dimethylspiro[2.4]heptan-2-yl)methyl]-2-methylpropan-1-amine
CID 79863729
N-[[2-(4-ethylcyclohexyl)cyclopentyl]methyl]-2-methylpropan-1-amine
CID 81028909

Frequently Asked Questions

What is the IUPAC name of N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine (CID 62712279) is N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine is CCC1CCC2(CC1)CC2CNCC(C)C.
What is the InChIKey of N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine?
The InChIKey is YUUFMIIZEIXBGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-4-13-5-7-15(8-6-13)9-14(15)11-16-10-12(2)3/h12-14,16H,4-11H2,1-3H3.
What are the key properties of N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine?
N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-ethylspiro[2.5]octan-2-yl)methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 62712279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).