N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide

C17H26N2O2 — CID 63127671

IUPACN-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCC(O)c2ccccc2)CCNCC1
InChIInChI=1S/C17H26N2O2/c1-2-8-17(9-11-18-12-10-17)16(21)19-13-15(20)14-6-4-3-5-7-14/h3-7,15,18,20H,2,8-13H2,1H3,(H,19,21)
InChIKeyAFJWLQNBQAWXHC-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.01
Rot. Bonds6

About N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide

N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide (PubChem CID 63127671) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide
PubChem CID63127671
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NCC(O)c2ccccc2)CCNCC1
InChIInChI=1S/C17H26N2O2/c1-2-8-17(9-11-18-12-10-17)16(21)19-13-15(20)14-6-4-3-5-7-14/h3-7,15,18,20H,2,8-13H2,1H3,(H,19,21)
InChIKeyAFJWLQNBQAWXHC-UHFFFAOYSA-N
XLogP2.01
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide
CID 106974225
N-(2-methylbutyl)-4-propylpiperidine-4-carboxamide
CID 63129494
3-methyl-4-[(4-propylpiperidine-4-carbonyl)amino]butanoic acid
CID 81073203
N-(2-hydroxy-2-phenylethyl)-9-propylfluorene-9-carboxamide
CID 22891520
N-(2-phenoxyethyl)-4-propylpiperidine-4-carboxamide
CID 63129005
N-(2-hydroxy-2-thiophen-3-ylethyl)-3-propylpiperidine-3-carboxamide
CID 106435467
N-[2-(dimethylamino)-3-methylbutyl]-4-propylpiperidine-4-carboxamide
CID 63128641
N-[(3-methylphenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63128555
N-[(4-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127194
N-[(3-chlorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127551
N-[(3-fluorophenyl)methyl]-4-propylpiperidine-4-carboxamide
CID 63127726
1-amino-N-(2-hydroxy-2-phenylethyl)cyclohexane-1-carboxamide
CID 43500059

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide?
The IUPAC name of N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide (CID 63127671) is N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide is CCCC1(C(=O)NCC(O)c2ccccc2)CCNCC1.
What is the InChIKey of N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide?
The InChIKey is AFJWLQNBQAWXHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-2-8-17(9-11-18-12-10-17)16(21)19-13-15(20)14-6-4-3-5-7-14/h3-7,15,18,20H,2,8-13H2,1H3,(H,19,21).
What are the key properties of N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide?
N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.01, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide is sourced from PubChem (CID 63127671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).