N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide

C14H19ClN2O2 — CID 103655893

IUPACN-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
SMILESCC(O)C1CCN(C(=O)Nc2cccc(Cl)c2)CC1
InChIInChI=1S/C14H19ClN2O2/c1-10(18)11-5-7-17(8-6-11)14(19)16-13-4-2-3-12(15)9-13/h2-4,9-11,18H,5-8H2,1H3,(H,16,19)
InChIKeyCIIXBMINVBCZCC-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.96
Rot. Bonds2

About N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide

N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide (PubChem CID 103655893) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
PubChem CID103655893
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC NameN-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
SMILESCC(O)C1CCN(C(=O)Nc2cccc(Cl)c2)CC1
InChIInChI=1S/C14H19ClN2O2/c1-10(18)11-5-7-17(8-6-11)14(19)16-13-4-2-3-12(15)9-13/h2-4,9-11,18H,5-8H2,1H3,(H,16,19)
InChIKeyCIIXBMINVBCZCC-UHFFFAOYSA-N
XLogP2.96
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chlorophenyl)-4-propan-2-ylpiperidine-1-carboxamide
CID 59001093
N-(3-chlorophenyl)-4-methylpiperidine-1-carboxamide
CID 707662
N-(3-chlorophenyl)-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-2-oxoacetamide
CID 110019344
N-[3-(aminomethyl)phenyl]-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 106836739
4-(1-hydroxyethyl)-N-(3-phenoxyphenyl)piperidine-1-carboxamide
CID 111424875
4-(1-hydroxyethyl)-N-[3-[methyl(propan-2-yl)amino]phenyl]piperidine-1-carboxamide
CID 111424931
N-(3-cyclopentyloxyphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111424820
4-N-(3-chlorophenyl)-1-N-methylpiperazine-1,4-dicarboxamide
CID 23932887
4-(azepan-1-yl)-N-(3-chlorophenyl)piperidine-1-carboxamide
CID 110667169
2-[1-[(3-chlorophenyl)carbamoyl]piperidin-4-yl]acetic acid
CID 53214090
N-(4-bromo-3-methylphenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111112986
N-(4-bromo-3-fluorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide
CID 111475420

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide (CID 103655893) is N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide is CC(O)C1CCN(C(=O)Nc2cccc(Cl)c2)CC1.
What is the InChIKey of N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide?
The InChIKey is CIIXBMINVBCZCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-10(18)11-5-7-17(8-6-11)14(19)16-13-4-2-3-12(15)9-13/h2-4,9-11,18H,5-8H2,1H3,(H,16,19).
What are the key properties of N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide?
N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide has a molecular weight of 282.77 g/mol, XLogP of 2.96, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-4-(1-hydroxyethyl)piperidine-1-carboxamide is sourced from PubChem (CID 103655893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).