N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide

C15H22N2O2 — CID 106121411

IUPACN-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)NCC1CCC(N)C1
InChIInChI=1S/C15H22N2O2/c1-10-3-6-14(19-2)13(7-10)15(18)17-9-11-4-5-12(16)8-11/h3,6-7,11-12H,4-5,8-9,16H2,1-2H3,(H,17,18)
InChIKeyNOGVSORVFUBBCZ-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.86
Rot. Bonds4

About N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide

N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide (PubChem CID 106121411) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide.

Molecular Properties

Compound NameN-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide
PubChem CID106121411
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)NCC1CCC(N)C1
InChIInChI=1S/C15H22N2O2/c1-10-3-6-14(19-2)13(7-10)15(18)17-9-11-4-5-12(16)8-11/h3,6-7,11-12H,4-5,8-9,16H2,1-2H3,(H,17,18)
InChIKeyNOGVSORVFUBBCZ-UHFFFAOYSA-N
XLogP1.86
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-5-methyl-N-[(6-methylpiperidin-3-yl)methyl]benzamide
CID 63009230
N-[(4-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide
CID 106124287
N-[(3-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide
CID 106123350
5-chloro-N-[(3-chlorocyclopentyl)methyl]-2-methoxybenzamide
CID 114146911
5-amino-2-methoxy-N-(oxan-4-ylmethyl)benzamide
CID 55226609
N-[(3-aminocyclohexyl)methyl]-2,4-dimethoxybenzamide
CID 106123339
N-[(4-aminocyclohexyl)methyl]-3,4-dimethoxybenzamide
CID 106124772
5-chloro-N-(cyclohexylmethyl)-2-methoxybenzamide
CID 2666780
2-hydroxy-N-[(3-hydroxycyclopentyl)methyl]-5-methylbenzamide
CID 103279879
[(3aR,7aS)-5-amino-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-(2-methoxy-5-methylphenyl)methanone
CID 62503543
N-[(3-aminocyclohexyl)methyl]-2-fluoro-4-methoxybenzamide
CID 106123955
N-[(3-aminocyclobutyl)methyl]-3,4-dimethoxybenzamide
CID 66004934

Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide?
The IUPAC name of N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide (CID 106121411) is N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide.
What is the SMILES notation for N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide?
The canonical SMILES for N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide is COc1ccc(C)cc1C(=O)NCC1CCC(N)C1.
What is the InChIKey of N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide?
The InChIKey is NOGVSORVFUBBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-3-6-14(19-2)13(7-10)15(18)17-9-11-4-5-12(16)8-11/h3,6-7,11-12H,4-5,8-9,16H2,1-2H3,(H,17,18).
What are the key properties of N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide?
N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide has a molecular weight of 262.35 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclopentyl)methyl]-2-methoxy-5-methylbenzamide is sourced from PubChem (CID 106121411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).