1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide

C17H25NO3 — CID 111102357

IUPAC1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide
SMILESCOc1ccc(C(C)(C)CNC(=O)C2(O)CCCC2)cc1
InChIInChI=1S/C17H25NO3/c1-16(2,13-6-8-14(21-3)9-7-13)12-18-15(19)17(20)10-4-5-11-17/h6-9,20H,4-5,10-12H2,1-3H3,(H,18,19)
InChIKeyJJCQZNWGIHYTMZ-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.39
Rot. Bonds5

About 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide

1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide (PubChem CID 111102357) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide
PubChem CID111102357
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC Name1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide
SMILESCOc1ccc(C(C)(C)CNC(=O)C2(O)CCCC2)cc1
InChIInChI=1S/C17H25NO3/c1-16(2,13-6-8-14(21-3)9-7-13)12-18-15(19)17(20)10-4-5-11-17/h6-9,20H,4-5,10-12H2,1-3H3,(H,18,19)
InChIKeyJJCQZNWGIHYTMZ-UHFFFAOYSA-N
XLogP2.39
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-hydroxy-N-[(4-methoxyphenyl)methyl]cyclohexane-1-carboxamide
CID 140694545
1-amino-N-[2-(3,4-dimethoxyphenyl)-2-methylpropyl]cyclohexane-1-carboxamide
CID 119320138
3-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]propanamide
CID 115139502
1-hydroxy-N-(2-methoxy-2-methylpropyl)cyclopentane-1-carboxamide
CID 111485529
1-[(4-chlorophenyl)methyl]-3-[2-(4-methoxyphenyl)-2-methylpropyl]urea
CID 113213547
N-[2-(4-methoxyphenyl)-2-methylpropyl]oxolane-2-carboxamide
CID 47472788
N-[2-(4-methoxyphenyl)-2-methylpropyl]pentanamide
CID 113090425
N-[2-(4-methoxyphenyl)-2-methylpropyl]-4-(trifluoromethyl)benzamide
CID 113090468
N-[2-(4-methoxyphenyl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119758276
1-(4-hydroxy-2,2-dimethylbutyl)-3-[2-(4-methoxyphenyl)-2-methylpropyl]urea
CID 111505453
4-amino-N-[2-(4-methoxyphenyl)-2-methylpropyl]butanamide
CID 110460825
N-[2-(4-methoxyphenyl)-2-methylpropyl]-2-(4-methylphenoxy)acetamide
CID 113090463

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide (CID 111102357) is 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide is COc1ccc(C(C)(C)CNC(=O)C2(O)CCCC2)cc1.
What is the InChIKey of 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide?
The InChIKey is JJCQZNWGIHYTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-16(2,13-6-8-14(21-3)9-7-13)12-18-15(19)17(20)10-4-5-11-17/h6-9,20H,4-5,10-12H2,1-3H3,(H,18,19).
What are the key properties of 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide?
1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide has a molecular weight of 291.39 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-[2-(4-methoxyphenyl)-2-methylpropyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 111102357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).