3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide

C14H20N2O2 — CID 114510061

IUPAC3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide
SMILESCCC1CN(C(=O)Nc2ccccc2)CCC1O
InChIInChI=1S/C14H20N2O2/c1-2-11-10-16(9-8-13(11)17)14(18)15-12-6-4-3-5-7-12/h3-7,11,13,17H,2,8-10H2,1H3,(H,15,18)
InChIKeyVBMCZERAYMWUGD-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.31
Rot. Bonds2

About 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide

3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide (PubChem CID 114510061) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide
PubChem CID114510061
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide
SMILESCCC1CN(C(=O)Nc2ccccc2)CCC1O
InChIInChI=1S/C14H20N2O2/c1-2-11-10-16(9-8-13(11)17)14(18)15-12-6-4-3-5-7-12/h3-7,11,13,17H,2,8-10H2,1H3,(H,15,18)
InChIKeyVBMCZERAYMWUGD-UHFFFAOYSA-N
XLogP2.31
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3R,4S)-3-[2-(diethylamino)ethyl]-1-(phenylcarbamoyl)piperidin-4-yl]acetic acid
CID 28959550
(3R)-3-amino-N-phenylpyrrolidine-1-carboxamide
CID 94340040
N-phenyl-4-(propylamino)piperidine-1-carboxamide
CID 54923338
1-(3-ethyl-4-hydroxypiperidin-1-yl)-2-methyl-2-phenylpropan-1-one
CID 114509918
3-(diethylamino)-N-phenylazetidine-1-carboxamide
CID 23140628
4-benzyl-N-phenylpiperidine-1-carboxamide
CID 5064762
1-[2-[(3R,4S)-4-(carboxymethyl)-1-(phenylcarbamoyl)piperidin-3-yl]ethyl]piperidine-4-carboxylic acid
CID 28959506
1-(phenylcarbamoyl)piperidine-4-carboxylate
CID 2113074
4-[(S)-hydroxy(phenyl)methyl]-N-phenylpiperidine-1-carboxamide
CID 51547304
4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]methyl]-N-phenylpiperidine-1-carboxamide
CID 92731331
4,4-dimethyl-N-phenylpiperidine-1-carboxamide
CID 110749467
N-phenyl-4-propylpiperazine-1-carboxamide
CID 17383007

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide (CID 114510061) is 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide is CCC1CN(C(=O)Nc2ccccc2)CCC1O.
What is the InChIKey of 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide?
The InChIKey is VBMCZERAYMWUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-2-11-10-16(9-8-13(11)17)14(18)15-12-6-4-3-5-7-12/h3-7,11,13,17H,2,8-10H2,1H3,(H,15,18).
What are the key properties of 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide?
3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 2.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-hydroxy-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 114510061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).