N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide

C16H22N2O3 — CID 94800761

IUPACN-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide
SMILESCC(C)C(=O)N[C@@H]1CCCN(C(=O)c2ccccc2O)C1
InChIInChI=1S/C16H22N2O3/c1-11(2)15(20)17-12-6-5-9-18(10-12)16(21)13-7-3-4-8-14(13)19/h3-4,7-8,11-12,19H,5-6,9-10H2,1-2H3,(H,17,20)/t12-/m1/s1
InChIKeyBLHVEGSRGLDXBQ-GFCCVEGCSA-N
MW290.36 g/mol
LogP1.77
Rot. Bonds3

About N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide

N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide (PubChem CID 94800761) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide
PubChem CID94800761
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide
SMILESCC(C)C(=O)N[C@@H]1CCCN(C(=O)c2ccccc2O)C1
InChIInChI=1S/C16H22N2O3/c1-11(2)15(20)17-12-6-5-9-18(10-12)16(21)13-7-3-4-8-14(13)19/h3-4,7-8,11-12,19H,5-6,9-10H2,1-2H3,(H,17,20)/t12-/m1/s1
InChIKeyBLHVEGSRGLDXBQ-GFCCVEGCSA-N
XLogP1.77
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3S)-1-(2-fluoro-6-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide
CID 99595335
(2-hydroxyphenyl)-(3-methylpiperidin-1-yl)methanone
CID 43176525
2-methyl-N-[1-(2-phenylacetyl)piperidin-3-yl]propanamide
CID 127187955
2-methyl-N-[(3S)-1-(1-phenylpyrazole-3-carbonyl)piperidin-3-yl]propanamide
CID 94800796
2-chloro-N-[1-(2-hydroxybenzoyl)piperidin-4-yl]propanamide
CID 108564395
[3-(methylamino)piperidin-1-yl]-(2-propan-2-ylsulfanylphenyl)methanone
CID 119491726
2-hydroxy-N-(1-methylpiperidin-3-yl)benzamide
CID 47344376
(3R)-1-(2-hydroxybenzoyl)piperidine-3-carboxylic acid
CID 30049767
[3-(methylamino)piperidin-1-yl]-(2-propan-2-ylsulfanylphenyl)methanone;hydrochloride
CID 119491725
2-methyl-N-[(3R)-1-[(2S)-3-methylsulfanyl-2-phenylpropanoyl]piperidin-3-yl]propanamide
CID 97216590
N-[1-[2-(2-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-2-methylpropanamide
CID 136580259
N-[3-[(3R)-3-(2-methylpropanoylamino)piperidine-1-carbonyl]phenyl]cyclopropanecarboxamide
CID 52512641

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide?
The IUPAC name of N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide (CID 94800761) is N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide.
What is the SMILES notation for N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide?
The canonical SMILES for N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide is CC(C)C(=O)N[C@@H]1CCCN(C(=O)c2ccccc2O)C1.
What is the InChIKey of N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide?
The InChIKey is BLHVEGSRGLDXBQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-11(2)15(20)17-12-6-5-9-18(10-12)16(21)13-7-3-4-8-14(13)19/h3-4,7-8,11-12,19H,5-6,9-10H2,1-2H3,(H,17,20)/t12-/m1/s1.
What are the key properties of N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide?
N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide has a molecular weight of 290.36 g/mol, XLogP of 1.77, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-(2-hydroxybenzoyl)piperidin-3-yl]-2-methylpropanamide is sourced from PubChem (CID 94800761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).