N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide

C19H21ClN2O2 — CID 110890318

IUPACN-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
SMILESO=C(Nc1ccccc1Cl)N1CCC(C(O)c2ccccc2)CC1
InChIInChI=1S/C19H21ClN2O2/c20-16-8-4-5-9-17(16)21-19(24)22-12-10-15(11-13-22)18(23)14-6-2-1-3-7-14/h1-9,15,18,23H,10-13H2,(H,21,24)
InChIKeyFEBLJPNOGJJDGW-UHFFFAOYSA-N
MW344.84 g/mol
LogP4.32
Rot. Bonds3

About N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide

N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide (PubChem CID 110890318) has the molecular formula C19H21ClN2O2 and a molecular weight of 344.84 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
PubChem CID110890318
Molecular FormulaC19H21ClN2O2
Molecular Weight344.84 g/mol
Exact Mass344.13
IUPAC NameN-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
SMILESO=C(Nc1ccccc1Cl)N1CCC(C(O)c2ccccc2)CC1
InChIInChI=1S/C19H21ClN2O2/c20-16-8-4-5-9-17(16)21-19(24)22-12-10-15(11-13-22)18(23)14-6-2-1-3-7-14/h1-9,15,18,23H,10-13H2,(H,21,24)
InChIKeyFEBLJPNOGJJDGW-UHFFFAOYSA-N
XLogP4.32
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.84
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-chlorophenoxy)phenyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
CID 55698903
4-[(S)-hydroxy(phenyl)methyl]-N-phenylpiperidine-1-carboxamide
CID 51547304
N-(4-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
CID 110884355
4-[(2S)-1-(2-chloroanilino)-1-oxopropan-2-yl]-N-phenylpiperidine-1-carboxamide
CID 95065297
2-(2,6-dichlorophenyl)-1-[4-[hydroxy(phenyl)methyl]piperidin-1-yl]ethanone
CID 55589570
N-cyclopentyl-4-[(R)-hydroxy(phenyl)methyl]piperidine-1-carboxamide
CID 38206268
N-(2-chlorophenyl)-4-(ethylaminomethyl)piperidine-1-carboxamide
CID 80552313
N-(2-chlorophenyl)-6-azaspiro[2.5]octane-6-carboxamide
CID 97374347
(3S)-N-(2-chlorophenyl)-3-(methylamino)pyrrolidine-1-carboxamide
CID 172646373
4-[(R)-hydroxy(phenyl)methyl]-N-(5-methyl-1,2-oxazol-3-yl)piperidine-1-carboxamide
CID 30598601
2-(2-chlorophenyl)sulfanyl-1-[4-[hydroxy(phenyl)methyl]piperidin-1-yl]propan-1-one
CID 55832752
N-[6-(dimethylamino)-2-pyridinyl]-4-[(R)-hydroxy(phenyl)methyl]piperidine-1-carboxamide
CID 99696818

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide (CID 110890318) is N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide is O=C(Nc1ccccc1Cl)N1CCC(C(O)c2ccccc2)CC1.
What is the InChIKey of N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide?
The InChIKey is FEBLJPNOGJJDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O2/c20-16-8-4-5-9-17(16)21-19(24)22-12-10-15(11-13-22)18(23)14-6-2-1-3-7-14/h1-9,15,18,23H,10-13H2,(H,21,24).
What are the key properties of N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide?
N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide has a molecular weight of 344.84 g/mol, XLogP of 4.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 110890318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).