N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide

C23H25N3O3 — CID 46446186

IUPACN-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide
SMILESO=C(Nc1ccccc1C(=O)N1CCC(NC(=O)C2CC2)CC1)c1ccccc1
InChIInChI=1S/C23H25N3O3/c27-21(17-10-11-17)24-18-12-14-26(15-13-18)23(29)19-8-4-5-9-20(19)25-22(28)16-6-2-1-3-7-16/h1-9,17-18H,10-15H2,(H,24,27)(H,25,28)
InChIKeyOCZAVFUBOBBRSS-UHFFFAOYSA-N
MW391.47 g/mol
LogP3.07
Rot. Bonds5

About N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide

N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide (PubChem CID 46446186) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide.

Molecular Properties

Compound NameN-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide
PubChem CID46446186
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC NameN-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide
SMILESO=C(Nc1ccccc1C(=O)N1CCC(NC(=O)C2CC2)CC1)c1ccccc1
InChIInChI=1S/C23H25N3O3/c27-21(17-10-11-17)24-18-12-14-26(15-13-18)23(29)19-8-4-5-9-20(19)25-22(28)16-6-2-1-3-7-16/h1-9,17-18H,10-15H2,(H,24,27)(H,25,28)
InChIKeyOCZAVFUBOBBRSS-UHFFFAOYSA-N
XLogP3.07
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]benzoic acid
CID 113083284
N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide
CID 32904614
N-[1-(2-bromobenzoyl)piperidin-4-yl]cyclopropanecarboxamide
CID 60758403
N-[1-(2-aminobenzoyl)piperidin-4-yl]cyclopropanecarboxamide
CID 60960262
N-(1-benzoylpiperidin-4-yl)cyclopentanecarboxamide
CID 110820191
1-N,4-N-bis[2-(azepane-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 4938376
N-[2-[4-(methylaminomethyl)piperidine-1-carbonyl]phenyl]benzamide;hydrochloride
CID 119545134
4-methyl-N-[2-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
CID 566959
4-(cyclopropanecarbonylamino)-N-[2-(3,5-dimethylpiperidine-1-carbonyl)phenyl]benzamide
CID 46442929
N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclobutanecarboxamide
CID 110820253
4-[[2-(4-methylpiperidine-1-carbonyl)phenyl]carbamoylamino]cyclohexane-1-carboxylic acid
CID 122077257
N-[2-[3-(methylaminomethyl)pyrrolidine-1-carbonyl]phenyl]benzamide
CID 119540740

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide?
The IUPAC name of N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide (CID 46446186) is N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide.
What is the SMILES notation for N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide?
The canonical SMILES for N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide is O=C(Nc1ccccc1C(=O)N1CCC(NC(=O)C2CC2)CC1)c1ccccc1.
What is the InChIKey of N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide?
The InChIKey is OCZAVFUBOBBRSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c27-21(17-10-11-17)24-18-12-14-26(15-13-18)23(29)19-8-4-5-9-20(19)25-22(28)16-6-2-1-3-7-16/h1-9,17-18H,10-15H2,(H,24,27)(H,25,28).
What are the key properties of N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide?
N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide has a molecular weight of 391.47 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]phenyl]benzamide is sourced from PubChem (CID 46446186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).