1-cyclooctyl-3-cyclopropylpropan-1-amine

C14H27N — CID 80603761

IUPAC1-cyclooctyl-3-cyclopropylpropan-1-amine
SMILESNC(CCC1CC1)C1CCCCCCC1
InChIInChI=1S/C14H27N/c15-14(11-10-12-8-9-12)13-6-4-2-1-3-5-7-13/h12-14H,1-11,15H2
InChIKeyILZHHLLSDZIOHZ-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.86
Rot. Bonds4

About 1-cyclooctyl-3-cyclopropylpropan-1-amine

1-cyclooctyl-3-cyclopropylpropan-1-amine (PubChem CID 80603761) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 1-cyclooctyl-3-cyclopropylpropan-1-amine.

Molecular Properties

Compound Name1-cyclooctyl-3-cyclopropylpropan-1-amine
PubChem CID80603761
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name1-cyclooctyl-3-cyclopropylpropan-1-amine
SMILESNC(CCC1CC1)C1CCCCCCC1
InChIInChI=1S/C14H27N/c15-14(11-10-12-8-9-12)13-6-4-2-1-3-5-7-13/h12-14H,1-11,15H2
InChIKeyILZHHLLSDZIOHZ-UHFFFAOYSA-N
XLogP3.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-cyclooctyl-3-cyclopropylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-cyclohexyl-1-cyclopropylpropan-1-amine
CID 63355132
1-cyclohexyl-4,4,4-trifluorobutan-1-amine
CID 64565147
(1S)-1,2-dicyclohexylethanamine
CID 44574818
2-cycloheptyl-1-cyclopentylethanamine
CID 115779065
1-cycloheptyl-4-cyclohexylbutan-2-amine
CID 114193048
2-cyclobutyl-1-cycloheptylethanamine
CID 65457005
(4S)-4-amino-4-cyclohexylbutan-1-ol
CID 102516079
1-cyclooctylpent-4-yn-1-amine
CID 80603767
(2S)-2-amino-4-cyclohexylbutan-1-ol
CID 11447105
3-cyclopropyl-1-(thian-2-yl)propan-1-amine
CID 80626885
1-cyclooctyl-5-methylhexan-1-amine
CID 83162244
1-cyclobutyl-3-(oxan-2-yl)propan-1-amine
CID 105049432

Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-3-cyclopropylpropan-1-amine?
The IUPAC name of 1-cyclooctyl-3-cyclopropylpropan-1-amine (CID 80603761) is 1-cyclooctyl-3-cyclopropylpropan-1-amine.
What is the SMILES notation for 1-cyclooctyl-3-cyclopropylpropan-1-amine?
The canonical SMILES for 1-cyclooctyl-3-cyclopropylpropan-1-amine is NC(CCC1CC1)C1CCCCCCC1.
What is the InChIKey of 1-cyclooctyl-3-cyclopropylpropan-1-amine?
The InChIKey is ILZHHLLSDZIOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c15-14(11-10-12-8-9-12)13-6-4-2-1-3-5-7-13/h12-14H,1-11,15H2.
What are the key properties of 1-cyclooctyl-3-cyclopropylpropan-1-amine?
1-cyclooctyl-3-cyclopropylpropan-1-amine has a molecular weight of 209.38 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-3-cyclopropylpropan-1-amine is sourced from PubChem (CID 80603761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).