4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol

C15H29NO2 — CID 79123923

IUPAC4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol
SMILESCCCC1CC(O)(C2(CN)CCC(C)C2)CCO1
InChIInChI=1S/C15H29NO2/c1-3-4-13-10-15(17,7-8-18-13)14(11-16)6-5-12(2)9-14/h12-13,17H,3-11,16H2,1-2H3
InChIKeyDRMXYUAPCMINTD-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.46
Rot. Bonds4

About 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol

4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol (PubChem CID 79123923) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol.

Molecular Properties

Compound Name4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol
PubChem CID79123923
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol
SMILESCCCC1CC(O)(C2(CN)CCC(C)C2)CCO1
InChIInChI=1S/C15H29NO2/c1-3-4-13-10-15(17,7-8-18-13)14(11-16)6-5-12(2)9-14/h12-13,17H,3-11,16H2,1-2H3
InChIKeyDRMXYUAPCMINTD-UHFFFAOYSA-N
XLogP2.46
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-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-[4-(aminomethyl)oxan-4-yl]-2-propyloxan-4-ol
CID 79125186
4-[2-(aminomethyl)-1,3-dihydroinden-2-yl]-2-propyloxan-4-ol
CID 79123419
4-[1-(aminomethyl)-3-methylcyclopentyl]-1-propylpiperidin-4-ol
CID 79135208
1-(4-hydroxy-2-propyloxan-4-yl)-3-methylcyclohexane-1-carbonitrile
CID 79132506
1-[1-(aminomethyl)-3-methylcyclopentyl]cycloheptan-1-ol
CID 79128862
4-[1-(aminomethyl)-3-methylcyclopentyl]-1-propylazepan-4-ol
CID 79124838
4-[1-(aminomethyl)-3-methylcyclopentyl]-1-methylpiperidin-4-ol
CID 79135647
1-[1-(aminomethyl)-4-propylcyclohexyl]-4-methylcyclohexan-1-ol
CID 79128311
1-[1-(aminomethyl)-3-ethylcyclopentyl]-3-methylcyclopentan-1-ol
CID 79126426
1-[1-(aminomethyl)-4-propylcyclohexyl]-3,5-dimethylcyclohexan-1-ol
CID 79123452
4-[1-(aminomethyl)-4-propylcyclohexyl]oxan-4-ol
CID 79135491
1-[1-(aminomethyl)cyclobutyl]-3-methylcyclopentan-1-ol
CID 79124196

Frequently Asked Questions

What is the IUPAC name of 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol?
The IUPAC name of 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol (CID 79123923) is 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol.
What is the SMILES notation for 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol?
The canonical SMILES for 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol is CCCC1CC(O)(C2(CN)CCC(C)C2)CCO1.
What is the InChIKey of 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol?
The InChIKey is DRMXYUAPCMINTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-3-4-13-10-15(17,7-8-18-13)14(11-16)6-5-12(2)9-14/h12-13,17H,3-11,16H2,1-2H3.
What are the key properties of 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol?
4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol has a molecular weight of 255.40 g/mol, XLogP of 2.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(aminomethyl)-3-methylcyclopentyl]-2-propyloxan-4-ol is sourced from PubChem (CID 79123923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).