3-[1-(aminomethyl)cyclohexyl]propan-1-ol

C10H21NO — CID 169495228

IUPAC3-[1-(aminomethyl)cyclohexyl]propan-1-ol
SMILESNCC1(CCCO)CCCCC1
InChIInChI=1S/C10H21NO/c11-9-10(7-4-8-12)5-2-1-3-6-10/h12H,1-9,11H2
InChIKeySQDDNTWKQVDMBL-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.67
Rot. Bonds4

About 3-[1-(aminomethyl)cyclohexyl]propan-1-ol

3-[1-(aminomethyl)cyclohexyl]propan-1-ol (PubChem CID 169495228) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 3-[1-(aminomethyl)cyclohexyl]propan-1-ol.

Molecular Properties

Compound Name3-[1-(aminomethyl)cyclohexyl]propan-1-ol
PubChem CID169495228
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name3-[1-(aminomethyl)cyclohexyl]propan-1-ol
SMILESNCC1(CCCO)CCCCC1
InChIInChI=1S/C10H21NO/c11-9-10(7-4-8-12)5-2-1-3-6-10/h12H,1-9,11H2
InChIKeySQDDNTWKQVDMBL-UHFFFAOYSA-N
XLogP1.67
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[1-(aminomethyl)cyclohexyl]propan-1-ol 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

(1-pentylcyclopentyl)methanamine
CID 62725889
6a-(3-hydroxypropyl)-1,2,3,4,5,6-hexahydropentalen-3a-ol
CID 15182683
[1-(4-methylpentyl)cyclopentyl]methanamine
CID 83169041
2-[1-(2-hydroxyethyl)cyclononadecyl]ethanol
CID 150954870
2-[1-(2-hydroxyethyl)cyclodecyl]ethanol
CID 18618783
[1-(aminomethyl)cyclohexyl]methanamine;platinum(2+);dichloride
CID 10250859
[1-(3,3-dimethylbutyl)cyclooctyl]methanamine
CID 80603562
[1-[2-(8-azaspiro[4.5]decan-8-yl)ethyl]cyclohexyl]methanamine
CID 104678904
(1-ethylcyclooctyl)methanamine
CID 80604065
[1-(chloromethyl)cyclohexyl]methanamine
CID 55255403
[1-(2-cyclohexylethyl)cycloheptyl]methanamine
CID 114193187
2-[1,4-bis(aminomethyl)cyclohexyl]ethanol
CID 86735230

Frequently Asked Questions

What is the IUPAC name of 3-[1-(aminomethyl)cyclohexyl]propan-1-ol?
The IUPAC name of 3-[1-(aminomethyl)cyclohexyl]propan-1-ol (CID 169495228) is 3-[1-(aminomethyl)cyclohexyl]propan-1-ol.
What is the SMILES notation for 3-[1-(aminomethyl)cyclohexyl]propan-1-ol?
The canonical SMILES for 3-[1-(aminomethyl)cyclohexyl]propan-1-ol is NCC1(CCCO)CCCCC1.
What is the InChIKey of 3-[1-(aminomethyl)cyclohexyl]propan-1-ol?
The InChIKey is SQDDNTWKQVDMBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c11-9-10(7-4-8-12)5-2-1-3-6-10/h12H,1-9,11H2.
What are the key properties of 3-[1-(aminomethyl)cyclohexyl]propan-1-ol?
3-[1-(aminomethyl)cyclohexyl]propan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.67, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(aminomethyl)cyclohexyl]propan-1-ol is sourced from PubChem (CID 169495228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).