1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide

C20H24N2O2 — CID 110907736

IUPAC1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide
SMILESCC(Nc1ccc(NC(=O)C2(O)CCCC2)cc1)c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-15(16-7-3-2-4-8-16)21-17-9-11-18(12-10-17)22-19(23)20(24)13-5-6-14-20/h2-4,7-12,15,21,24H,5-6,13-14H2,1H3,(H,22,23)
InChIKeyPEPSONLICWRVAA-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.10
Rot. Bonds5

About 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide

1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide (PubChem CID 110907736) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide
PubChem CID110907736
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide
SMILESCC(Nc1ccc(NC(=O)C2(O)CCCC2)cc1)c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-15(16-7-3-2-4-8-16)21-17-9-11-18(12-10-17)22-19(23)20(24)13-5-6-14-20/h2-4,7-12,15,21,24H,5-6,13-14H2,1H3,(H,22,23)
InChIKeyPEPSONLICWRVAA-UHFFFAOYSA-N
XLogP4.10
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide (CID 110907736) is 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide is CC(Nc1ccc(NC(=O)C2(O)CCCC2)cc1)c1ccccc1.
What is the InChIKey of 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide?
The InChIKey is PEPSONLICWRVAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15(16-7-3-2-4-8-16)21-17-9-11-18(12-10-17)22-19(23)20(24)13-5-6-14-20/h2-4,7-12,15,21,24H,5-6,13-14H2,1H3,(H,22,23).
What are the key properties of 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide?
1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide has a molecular weight of 324.42 g/mol, XLogP of 4.10, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-[4-(1-phenylethylamino)phenyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 110907736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).