1-(2-aminoethyl)-4-propylcyclohexan-1-ol

C11H23NO — CID 79128310

IUPAC1-(2-aminoethyl)-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)(CCN)CC1
InChIInChI=1S/C11H23NO/c1-2-3-10-4-6-11(13,7-5-10)8-9-12/h10,13H,2-9,12H2,1H3
InChIKeyPUIBOLGHRQOQGT-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.06
Rot. Bonds4

About 1-(2-aminoethyl)-4-propylcyclohexan-1-ol

1-(2-aminoethyl)-4-propylcyclohexan-1-ol (PubChem CID 79128310) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-(2-aminoethyl)-4-propylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(2-aminoethyl)-4-propylcyclohexan-1-ol
PubChem CID79128310
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-(2-aminoethyl)-4-propylcyclohexan-1-ol
SMILESCCCC1CCC(O)(CCN)CC1
InChIInChI=1S/C11H23NO/c1-2-3-10-4-6-11(13,7-5-10)8-9-12/h10,13H,2-9,12H2,1H3
InChIKeyPUIBOLGHRQOQGT-UHFFFAOYSA-N
XLogP2.06
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(2-aminoethyl)-4-propylcyclohexan-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-(1-hydroxy-4-propylcyclohexyl)-4-propylcyclohexan-1-ol
CID 70888853
1-(propan-2-yloxymethyl)-4-propylcyclohexan-1-ol
CID 79568462
4-[1-(aminomethyl)-4-propylcyclohexyl]oxan-4-ol
CID 79135491
1-ethyl-4-[2-(4-ethylcyclohexyl)ethyl]cyclohexan-1-ol
CID 139648654
1-[1-(aminomethyl)cyclooctyl]-4-propylcyclohexan-1-ol
CID 80603364
1-[1-(aminomethyl)-4-propylcyclohexyl]-4-methylcyclohexan-1-ol
CID 79128311
4-propyl-1-prop-2-ynylcycloheptan-1-ol
CID 65090248
1-[(2-methylpropylamino)methyl]-4-propylcyclohexan-1-ol
CID 62774717
1-(3-phenylpropyl)-4-propylcycloheptan-1-ol
CID 65151413
1-[1-(aminomethyl)-4-propylcyclohexyl]-3,5-dimethylcyclohexan-1-ol
CID 79123452
(1-methoxy-4-propylcyclohexyl)methanamine
CID 62107282
1-decyl-4-ethylcyclohexan-1-ol
CID 65147378

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminoethyl)-4-propylcyclohexan-1-ol?
The IUPAC name of 1-(2-aminoethyl)-4-propylcyclohexan-1-ol (CID 79128310) is 1-(2-aminoethyl)-4-propylcyclohexan-1-ol.
What is the SMILES notation for 1-(2-aminoethyl)-4-propylcyclohexan-1-ol?
The canonical SMILES for 1-(2-aminoethyl)-4-propylcyclohexan-1-ol is CCCC1CCC(O)(CCN)CC1.
What is the InChIKey of 1-(2-aminoethyl)-4-propylcyclohexan-1-ol?
The InChIKey is PUIBOLGHRQOQGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-2-3-10-4-6-11(13,7-5-10)8-9-12/h10,13H,2-9,12H2,1H3.
What are the key properties of 1-(2-aminoethyl)-4-propylcyclohexan-1-ol?
1-(2-aminoethyl)-4-propylcyclohexan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminoethyl)-4-propylcyclohexan-1-ol is sourced from PubChem (CID 79128310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).