N-(piperidin-4-ylcarbamoyl)benzamide

C13H17N3O2 — CID 12608582

IUPACN-(piperidin-4-ylcarbamoyl)benzamide
SMILESO=C(NC(=O)c1ccccc1)NC1CCNCC1
InChIInChI=1S/C13H17N3O2/c17-12(10-4-2-1-3-5-10)16-13(18)15-11-6-8-14-9-7-11/h1-5,11,14H,6-9H2,(H2,15,16,17,18)
InChIKeyVDPTZNWSWWZWNC-UHFFFAOYSA-N
MW247.30 g/mol
LogP0.88
Rot. Bonds2

About N-(piperidin-4-ylcarbamoyl)benzamide

N-(piperidin-4-ylcarbamoyl)benzamide (PubChem CID 12608582) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is N-(piperidin-4-ylcarbamoyl)benzamide.

Molecular Properties

Compound NameN-(piperidin-4-ylcarbamoyl)benzamide
PubChem CID12608582
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC NameN-(piperidin-4-ylcarbamoyl)benzamide
SMILESO=C(NC(=O)c1ccccc1)NC1CCNCC1
InChIInChI=1S/C13H17N3O2/c17-12(10-4-2-1-3-5-10)16-13(18)15-11-6-8-14-9-7-11/h1-5,11,14H,6-9H2,(H2,15,16,17,18)
InChIKeyVDPTZNWSWWZWNC-UHFFFAOYSA-N
XLogP0.88
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 50.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4S)-azepan-4-yl]benzamide
CID 146196053
2-benzamido-N-piperidin-4-ylbenzamide
CID 119388442
N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide
CID 12608588
N-(cyclopropylcarbamothioyl)benzamide
CID 3620996
(2R)-2-hydroxy-2-phenyl-N-piperidin-4-ylacetamide
CID 118541603
(2R)-2-phenyl-2-(piperidin-4-ylcarbamoylamino)acetic acid
CID 61402999
2-phenyl-N-piperidin-4-ylacetamide
CID 1445168
N-piperidin-3-ylbenzamide
CID 22017045
N-[(3R,4S)-3-hydroxypiperidin-4-yl]benzamide
CID 15096814
tert-butyl 4-(benzoylcarbamoylamino)piperidine-1-carboxylate
CID 58602980
3-phenoxy-N-piperidin-4-ylbenzamide
CID 71730778
N-piperidin-4-yl-4-sulfanylbenzamide
CID 107023949

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-4-ylcarbamoyl)benzamide?
The IUPAC name of N-(piperidin-4-ylcarbamoyl)benzamide (CID 12608582) is N-(piperidin-4-ylcarbamoyl)benzamide.
What is the SMILES notation for N-(piperidin-4-ylcarbamoyl)benzamide?
The canonical SMILES for N-(piperidin-4-ylcarbamoyl)benzamide is O=C(NC(=O)c1ccccc1)NC1CCNCC1.
What is the InChIKey of N-(piperidin-4-ylcarbamoyl)benzamide?
The InChIKey is VDPTZNWSWWZWNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c17-12(10-4-2-1-3-5-10)16-13(18)15-11-6-8-14-9-7-11/h1-5,11,14H,6-9H2,(H2,15,16,17,18).
What are the key properties of N-(piperidin-4-ylcarbamoyl)benzamide?
N-(piperidin-4-ylcarbamoyl)benzamide has a molecular weight of 247.30 g/mol, XLogP of 0.88, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-4-ylcarbamoyl)benzamide is sourced from PubChem (CID 12608582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).