3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide

C15H22N2O3 — CID 81090807

IUPAC3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide
SMILESCCOc1cc(N)cc(C(=O)NC2CCCC2OC)c1
InChIInChI=1S/C15H22N2O3/c1-3-20-12-8-10(7-11(16)9-12)15(18)17-13-5-4-6-14(13)19-2/h7-9,13-14H,3-6,16H2,1-2H3,(H,17,18)
InChIKeyXCGCROVDLYXGRO-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.96
Rot. Bonds5

About 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide

3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide (PubChem CID 81090807) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide.

Molecular Properties

Compound Name3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide
PubChem CID81090807
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide
SMILESCCOc1cc(N)cc(C(=O)NC2CCCC2OC)c1
InChIInChI=1S/C15H22N2O3/c1-3-20-12-8-10(7-11(16)9-12)15(18)17-13-5-4-6-14(13)19-2/h7-9,13-14H,3-6,16H2,1-2H3,(H,17,18)
InChIKeyXCGCROVDLYXGRO-UHFFFAOYSA-N
XLogP1.96
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-5-ethoxy-N-(2-methylcycloheptyl)benzamide
CID 81094286
3-amino-N-(2-methoxycyclopentyl)benzamide
CID 62086745
3-amino-N-(2,2-dimethylcyclopropyl)-5-ethoxybenzamide
CID 81090276
3-amino-N-(cyclopentylmethyl)-5-ethoxybenzamide
CID 81090073
3-amino-5-ethoxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 81094264
(3-amino-5-ethoxyphenyl)-(3,4-dimethoxypyrrolidin-1-yl)methanone
CID 103530161
methyl 3-amino-5-ethoxybenzoate
CID 45089063
4-amino-N-(2-methoxycyclopentyl)pyridine-2-carboxamide
CID 62159962
3-amino-4-methoxy-N-(2-methoxycyclopentyl)benzamide
CID 62088894
3-amino-4-bromo-N-(2-methoxycyclopentyl)benzamide
CID 62087821
N-(2-methoxycyclopentyl)-2-(propylamino)pyridine-4-carboxamide
CID 62181644
3-amino-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-5-ethoxybenzamide
CID 107843413

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide?
The IUPAC name of 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide (CID 81090807) is 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide.
What is the SMILES notation for 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide?
The canonical SMILES for 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide is CCOc1cc(N)cc(C(=O)NC2CCCC2OC)c1.
What is the InChIKey of 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide?
The InChIKey is XCGCROVDLYXGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-3-20-12-8-10(7-11(16)9-12)15(18)17-13-5-4-6-14(13)19-2/h7-9,13-14H,3-6,16H2,1-2H3,(H,17,18).
What are the key properties of 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide?
3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide has a molecular weight of 278.35 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-ethoxy-N-(2-methoxycyclopentyl)benzamide is sourced from PubChem (CID 81090807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).