1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide

C17H23NO2 — CID 110922755

IUPAC1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide
SMILESCc1ccccc1C1(CNC(=O)C2(O)CCCC2)CC1
InChIInChI=1S/C17H23NO2/c1-13-6-2-3-7-14(13)16(10-11-16)12-18-15(19)17(20)8-4-5-9-17/h2-3,6-7,20H,4-5,8-12H2,1H3,(H,18,19)
InChIKeyPNIICTFRJKUYIA-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.45
Rot. Bonds4

About 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide

1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide (PubChem CID 110922755) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide
PubChem CID110922755
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC Name1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide
SMILESCc1ccccc1C1(CNC(=O)C2(O)CCCC2)CC1
InChIInChI=1S/C17H23NO2/c1-13-6-2-3-7-14(13)16(10-11-16)12-18-15(19)17(20)8-4-5-9-17/h2-3,6-7,20H,4-5,8-12H2,1H3,(H,18,19)
InChIKeyPNIICTFRJKUYIA-UHFFFAOYSA-N
XLogP2.45
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclohexane-1-carboxamide
CID 119315839
2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride
CID 119315817
2-[[1-(2-methylphenyl)cyclopropyl]methylcarbamoylamino]propanediamide
CID 52910224
4-(methoxymethyl)-N-[[1-(2-methylphenyl)cyclohexyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 120629984
N-[[4-(2-methylphenyl)oxan-4-yl]methyl]acetamide
CID 47071133
3-amino-2-methyl-N-[[1-(2-methylphenyl)cyclohexyl]methyl]butanamide;hydrochloride
CID 120500104
N-methyl-1-[1-(2-methylphenyl)cycloheptyl]methanamine
CID 62596949
N-[[1-(2-methylphenyl)cyclopropyl]methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119315824
2-methyl-1-[[1-(2-methylphenyl)cyclopropyl]methyl]guanidine;hydroiodide
CID 110928186
3-[[1-(2-methylphenyl)cyclopropyl]methylamino]propanoic acid
CID 139017034
1-hydroxy-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
CID 110932725
2-(4-aminophenyl)-N-[[4-(2-methylphenyl)oxan-4-yl]methyl]acetamide
CID 119749794

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide (CID 110922755) is 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide is Cc1ccccc1C1(CNC(=O)C2(O)CCCC2)CC1.
What is the InChIKey of 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide?
The InChIKey is PNIICTFRJKUYIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-13-6-2-3-7-14(13)16(10-11-16)12-18-15(19)17(20)8-4-5-9-17/h2-3,6-7,20H,4-5,8-12H2,1H3,(H,18,19).
What are the key properties of 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide?
1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide has a molecular weight of 273.38 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 110922755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).