N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide

C14H20N2O3 — CID 79725712

IUPACN-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCCC2CN)cc1O
InChIInChI=1S/C14H20N2O3/c1-19-13-6-5-9(7-12(13)17)14(18)16-11-4-2-3-10(11)8-15/h5-7,10-11,17H,2-4,8,15H2,1H3,(H,16,18)
InChIKeyCDHUYNVWSGVKAV-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.26
Rot. Bonds4

About N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide

N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide (PubChem CID 79725712) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide
PubChem CID79725712
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCCC2CN)cc1O
InChIInChI=1S/C14H20N2O3/c1-19-13-6-5-9(7-12(13)17)14(18)16-11-4-2-3-10(11)8-15/h5-7,10-11,17H,2-4,8,15H2,1H3,(H,16,18)
InChIKeyCDHUYNVWSGVKAV-UHFFFAOYSA-N
XLogP1.26
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-3,4-dimethoxybenzamide;hydrochloride
CID 119602992
N-[2-(aminomethyl)cyclopentyl]-4-(2-amino-2-oxoethoxy)-3-methoxybenzamide;hydrochloride
CID 119601304
N-[2-(hydroxymethyl)cyclopentyl]-3,4-dimethoxybenzamide
CID 103751338
N-[2-(aminomethyl)cyclopentyl]-4-bromo-3,5-dimethoxybenzamide
CID 119600547
N-[2-(aminomethyl)cyclohexyl]-4-methoxy-3-(propan-2-ylsulfamoyl)benzamide
CID 119610116
N-[2-(aminomethyl)cyclohexyl]-3-(dimethylsulfamoyl)-4-methoxybenzamide
CID 119610980
N-[2-(aminomethyl)cyclopentyl]-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 119605114
N-[2-(aminomethyl)cyclopentyl]-3,4-dipropoxybenzamide;hydrochloride
CID 119604451
N-[2-(aminomethyl)cyclohexyl]-3,4,5-trimethoxybenzamide;hydrochloride
CID 119610035
N-[2-(aminomethyl)cyclopentyl]-2,5-dimethoxybenzamide;hydrochloride
CID 119602527
N-[2-(aminomethyl)cyclopentyl]-3-ethoxy-4-propoxybenzamide
CID 119603710
N-[2-(chloromethyl)cyclopentyl]-3-fluoro-4-methoxybenzamide
CID 106366034

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide (CID 79725712) is N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide is COc1ccc(C(=O)NC2CCCC2CN)cc1O.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide?
The InChIKey is CDHUYNVWSGVKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-19-13-6-5-9(7-12(13)17)14(18)16-11-4-2-3-10(11)8-15/h5-7,10-11,17H,2-4,8,15H2,1H3,(H,16,18).
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide?
N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide has a molecular weight of 264.32 g/mol, XLogP of 1.26, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-3-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 79725712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).