1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol

C14H22N2O — CID 65085479

IUPAC1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol
SMILESCCC1CCCC(O)(c2cccnc2N)CC1
InChIInChI=1S/C14H22N2O/c1-2-11-5-3-8-14(17,9-7-11)12-6-4-10-16-13(12)15/h4,6,10-11,17H,2-3,5,7-9H2,1H3,(H2,15,16)
InChIKeyUOFNNXZCCDIQMH-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.84
Rot. Bonds2

About 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol

1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol (PubChem CID 65085479) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol.

Molecular Properties

Compound Name1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol
PubChem CID65085479
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol
SMILESCCC1CCCC(O)(c2cccnc2N)CC1
InChIInChI=1S/C14H22N2O/c1-2-11-5-3-8-14(17,9-7-11)12-6-4-10-16-13(12)15/h4,6,10-11,17H,2-3,5,7-9H2,1H3,(H2,15,16)
InChIKeyUOFNNXZCCDIQMH-UHFFFAOYSA-N
XLogP2.84
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-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

4-ethyl-1-phenylcycloheptan-1-ol
CID 65085687
4-ethyl-1-[2-(2-methoxyethoxy)phenyl]cycloheptan-1-ol
CID 104658769
4-ethyl-1-(2,4,5-trimethylphenyl)cycloheptan-1-ol
CID 65086189
1-(2,4-dimethylphenyl)-4-ethylcycloheptan-1-ol
CID 65085735
3-ethyl-1-quinolin-5-ylcyclopentan-1-ol
CID 81216281
1-(2-amino-3-pyridinyl)-3,3,5,5-tetramethylcyclohexan-1-ol
CID 112682728
4-ethyl-1-(3-methylphenyl)cycloheptan-1-ol
CID 65085535
1-(2-amino-3-pyridinyl)-2,2-dimethylcyclohexan-1-ol
CID 79853038
3-ethyl-1-quinolin-8-ylcyclohexan-1-amine
CID 81216378
4-ethyl-1-thiophen-3-ylcycloheptan-1-ol
CID 65099566
4-ethyl-1-(3-fluoro-4-pyridinyl)cyclohexan-1-ol
CID 104737480
1-(2-methyl-3-pyridinyl)cyclobutan-1-ol
CID 89153359

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol?
The IUPAC name of 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol (CID 65085479) is 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol.
What is the SMILES notation for 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol?
The canonical SMILES for 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol is CCC1CCCC(O)(c2cccnc2N)CC1.
What is the InChIKey of 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol?
The InChIKey is UOFNNXZCCDIQMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-2-11-5-3-8-14(17,9-7-11)12-6-4-10-16-13(12)15/h4,6,10-11,17H,2-3,5,7-9H2,1H3,(H2,15,16).
What are the key properties of 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol?
1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 2.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-3-pyridinyl)-4-ethylcycloheptan-1-ol is sourced from PubChem (CID 65085479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).