3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide

C15H22N2O2 — CID 81092038

IUPAC3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide
SMILESCOc1cc(N)cc(C(=O)NC(C)C2CCCC2)c1
InChIInChI=1S/C15H22N2O2/c1-10(11-5-3-4-6-11)17-15(18)12-7-13(16)9-14(8-12)19-2/h7-11H,3-6,16H2,1-2H3,(H,17,18)
InChIKeyCLGKJUJHCXNTSO-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.59
Rot. Bonds4

About 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide

3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide (PubChem CID 81092038) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide.

Molecular Properties

Compound Name3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide
PubChem CID81092038
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide
SMILESCOc1cc(N)cc(C(=O)NC(C)C2CCCC2)c1
InChIInChI=1S/C15H22N2O2/c1-10(11-5-3-4-6-11)17-15(18)12-7-13(16)9-14(8-12)19-2/h7-11H,3-6,16H2,1-2H3,(H,17,18)
InChIKeyCLGKJUJHCXNTSO-UHFFFAOYSA-N
XLogP2.59
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 ≤ 52.59
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

3,5-diamino-N-(1-cyclopropylethyl)benzamide
CID 61094229
3-amino-N-(1-cyclohexylethyl)benzamide
CID 62404995
4-amino-N-(1-cyclopentylethyl)benzamide;hydrochloride
CID 119782446
2-amino-N-[(1R)-1-cyclohexylethyl]-5-methoxybenzamide
CID 115413669
3-amino-N-(4-hydroxycyclohexyl)-5-methoxybenzamide
CID 81090332
3-amino-5-methoxy-N-(1-methylcyclopentyl)benzamide
CID 78985061
3-amino-N-hexan-2-yl-5-methoxybenzamide
CID 81090278
[2-(cyclopentylamino)-2-oxoethyl] 3-amino-5-methoxybenzoate
CID 81095131
N-[(1R)-1-cyclohexylethyl]-4-[2-(4-methoxyphenyl)ethynyl]benzamide
CID 56587993
4-amino-N-[(1R)-1-cycloheptylethyl]-2-methoxybenzamide
CID 107207952
N-(1-cyclopentylethyl)-3-hydroxy-4-methoxybenzamide
CID 79672563
N-(1-cyclohexylethyl)-3,4,5-trifluorobenzamide
CID 63189611

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide?
The IUPAC name of 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide (CID 81092038) is 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide.
What is the SMILES notation for 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide?
The canonical SMILES for 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide is COc1cc(N)cc(C(=O)NC(C)C2CCCC2)c1.
What is the InChIKey of 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide?
The InChIKey is CLGKJUJHCXNTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10(11-5-3-4-6-11)17-15(18)12-7-13(16)9-14(8-12)19-2/h7-11H,3-6,16H2,1-2H3,(H,17,18).
What are the key properties of 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide?
3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide has a molecular weight of 262.35 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-cyclopentylethyl)-5-methoxybenzamide is sourced from PubChem (CID 81092038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).