2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide

C22H28N2O3 — CID 120593283

IUPAC2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide
SMILESCOc1ccc(CNC(=O)C(C)(N)c2ccccc2)c(OC2CCCC2)c1
InChIInChI=1S/C22H28N2O3/c1-22(23,17-8-4-3-5-9-17)21(25)24-15-16-12-13-19(26-2)14-20(16)27-18-10-6-7-11-18/h3-5,8-9,12-14,18H,6-7,10-11,15,23H2,1-2H3,(H,24,25)
InChIKeyCVAPGQZHUHMMMW-UHFFFAOYSA-N
MW368.48 g/mol
LogP3.51
Rot. Bonds7

About 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide

2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide (PubChem CID 120593283) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide
PubChem CID120593283
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC Name2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide
SMILESCOc1ccc(CNC(=O)C(C)(N)c2ccccc2)c(OC2CCCC2)c1
InChIInChI=1S/C22H28N2O3/c1-22(23,17-8-4-3-5-9-17)21(25)24-15-16-12-13-19(26-2)14-20(16)27-18-10-6-7-11-18/h3-5,8-9,12-14,18H,6-7,10-11,15,23H2,1-2H3,(H,24,25)
InChIKeyCVAPGQZHUHMMMW-UHFFFAOYSA-N
XLogP3.51
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[(2,4-dimethoxyphenyl)methyl]-2-phenylpropanamide
CID 120587952
2-amino-N-[(2-cyclopentyloxyphenyl)methyl]-2-phenylpropanamide;hydrochloride
CID 120588362
4-[(2-cyclopentyloxy-4-methoxyphenyl)methylamino]-2,2-dimethyl-4-oxobutanoic acid
CID 119142062
3-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-3-phenylpropanamide
CID 119952019
2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylacetamide;hydrochloride
CID 119334420
N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]prop-2-enamide
CID 146107018
1-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119334428
(2S)-2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-4-methylpentanamide;hydrochloride
CID 119802569
2-amino-N-[(4-methoxyphenyl)methyl]-2-phenylpropanamide
CID 62489084
N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-4-(methylamino)butanamide;hydrochloride
CID 119802521
N-[(2-cyclohexyloxy-4-methoxyphenyl)methyl]-2-methylpropan-2-amine
CID 63056453
2-(cyclopentylamino)-N-[(2,4-dimethoxyphenyl)methyl]acetamide
CID 63362881

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide?
The IUPAC name of 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide (CID 120593283) is 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide is COc1ccc(CNC(=O)C(C)(N)c2ccccc2)c(OC2CCCC2)c1.
What is the InChIKey of 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide?
The InChIKey is CVAPGQZHUHMMMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-22(23,17-8-4-3-5-9-17)21(25)24-15-16-12-13-19(26-2)14-20(16)27-18-10-6-7-11-18/h3-5,8-9,12-14,18H,6-7,10-11,15,23H2,1-2H3,(H,24,25).
What are the key properties of 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide?
2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide has a molecular weight of 368.48 g/mol, XLogP of 3.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-2-phenylpropanamide is sourced from PubChem (CID 120593283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).