N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide

C12H16N2O2 — CID 15096814

IUPACN-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide
SMILESO=C(N[C@H]1CCNC[C@H]1O)c1ccccc1
InChIInChI=1S/C12H16N2O2/c15-11-8-13-7-6-10(11)14-12(16)9-4-2-1-3-5-9/h1-5,10-11,13,15H,6-8H2,(H,14,16)/t10-,11+/m0/s1
InChIKeyOQYITJFGEOOJPO-WDEREUQCSA-N
MW220.27 g/mol
LogP0.14
Rot. Bonds2

About N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide

N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide (PubChem CID 15096814) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide.

Molecular Properties

Compound NameN-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide
PubChem CID15096814
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide
SMILESO=C(N[C@H]1CCNC[C@H]1O)c1ccccc1
InChIInChI=1S/C12H16N2O2/c15-11-8-13-7-6-10(11)14-12(16)9-4-2-1-3-5-9/h1-5,10-11,13,15H,6-8H2,(H,14,16)/t10-,11+/m0/s1
InChIKeyOQYITJFGEOOJPO-WDEREUQCSA-N
XLogP0.14
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylpiperidin-3-yl)benzamide
CID 63326220
N-[(3S,4S)-4-(hydroxymethyl)piperidin-3-yl]benzamide
CID 71836746
N-piperidin-3-ylbenzamide
CID 22017045
N-(2-benzamidocyclobutyl)benzamide
CID 58037122
N-[(1R,2R)-2-hydroxycyclopentyl]benzamide
CID 36691439
methyl 3-[4-[[(3R,4R)-3-hydroxypiperidin-4-yl]carbamoyl]phenyl]benzoate
CID 119070407
N-(2-hydroxycyclopropyl)benzamide
CID 175468011
4-(3,5-dimethoxyphenyl)-N-[(3R,4R)-3-hydroxypiperidin-4-yl]benzamide
CID 121498106
N-[(4S)-azepan-4-yl]benzamide
CID 146196053
2-benzylsulfonyl-N-[(3R,4R)-3-hydroxypiperidin-4-yl]benzamide
CID 70708699
1-benzyl-3-[(3R,4R)-3-hydroxypiperidin-4-yl]urea;hydrochloride
CID 154906200
4-iodo-N-(3-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120557720

Frequently Asked Questions

What is the IUPAC name of N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide?
The IUPAC name of N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide (CID 15096814) is N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide.
What is the SMILES notation for N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide?
The canonical SMILES for N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide is O=C(N[C@H]1CCNC[C@H]1O)c1ccccc1.
What is the InChIKey of N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide?
The InChIKey is OQYITJFGEOOJPO-WDEREUQCSA-N. The full InChI is InChI=1S/C12H16N2O2/c15-11-8-13-7-6-10(11)14-12(16)9-4-2-1-3-5-9/h1-5,10-11,13,15H,6-8H2,(H,14,16)/t10-,11+/m0/s1.
What are the key properties of N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide?
N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide has a molecular weight of 220.27 g/mol, XLogP of 0.14, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide is sourced from PubChem (CID 15096814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).