3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide

C14H20N2O2 — CID 113386375

IUPAC3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide
SMILESCOc1c(N)cccc1C(=O)NCC1CCCC1
InChIInChI=1S/C14H20N2O2/c1-18-13-11(7-4-8-12(13)15)14(17)16-9-10-5-2-3-6-10/h4,7-8,10H,2-3,5-6,9,15H2,1H3,(H,16,17)
InChIKeyKWGKLFGXLUUHNB-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.20
Rot. Bonds4

About 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide

3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide (PubChem CID 113386375) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide.

Molecular Properties

Compound Name3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide
PubChem CID113386375
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide
SMILESCOc1c(N)cccc1C(=O)NCC1CCCC1
InChIInChI=1S/C14H20N2O2/c1-18-13-11(7-4-8-12(13)15)14(17)16-9-10-5-2-3-6-10/h4,7-8,10H,2-3,5-6,9,15H2,1H3,(H,16,17)
InChIKeyKWGKLFGXLUUHNB-UHFFFAOYSA-N
XLogP2.20
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-(cyclohexylmethyl)benzamide
CID 43215482
3-amino-2-methoxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 114514863
N-[[1-(cyclohexylmethyl)piperidin-1-ium-4-yl]methyl]-2,3-dimethoxybenzamide
CID 7451565
2-amino-3-chloro-N-(cyclopentylmethyl)benzamide
CID 115540050
3-amino-N-[(2S)-2-hydroxypropyl]-2-methoxybenzamide
CID 107211143
3-amino-N-(4-hydroxybutyl)-2-methoxybenzamide
CID 106840121
N-(cyclohexylmethyl)-2,3-dihydroxybenzamide
CID 56679854
N-(cyclohexylmethyl)-3-hydroxy-2-methylbenzamide
CID 82826551
3-amino-N-(5-hydroxypentyl)-2-methoxybenzamide
CID 107316263
N-(cyclopentylmethyl)-2,3-difluorobenzamide
CID 62649354
N-[(1-cyclohexylpiperidin-3-yl)methyl]-2,3-dimethoxybenzamide
CID 23723921
2-amino-3-chloro-N-(cyclobutylmethyl)benzamide
CID 115540048

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide?
The IUPAC name of 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide (CID 113386375) is 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide.
What is the SMILES notation for 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide?
The canonical SMILES for 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide is COc1c(N)cccc1C(=O)NCC1CCCC1.
What is the InChIKey of 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide?
The InChIKey is KWGKLFGXLUUHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-18-13-11(7-4-8-12(13)15)14(17)16-9-10-5-2-3-6-10/h4,7-8,10H,2-3,5-6,9,15H2,1H3,(H,16,17).
What are the key properties of 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide?
3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide has a molecular weight of 248.33 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(cyclopentylmethyl)-2-methoxybenzamide is sourced from PubChem (CID 113386375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).