3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride

C17H24ClN3O2 — CID 119388968

IUPAC3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride
SMILESCC1CC1C(=O)Nc1cccc(C(=O)NC2CCNCC2)c1.Cl
InChIInChI=1S/C17H23N3O2.ClH/c1-11-9-15(11)17(22)20-14-4-2-3-12(10-14)16(21)19-13-5-7-18-8-6-13;/h2-4,10-11,13,15,18H,5-9H2,1H3,(H,19,21)(H,20,22);1H
InChIKeyJUCFVMSNANHTJJ-UHFFFAOYSA-N
MW337.85 g/mol
LogP2.18
Rot. Bonds4

About 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride

3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride (PubChem CID 119388968) has the molecular formula C17H24ClN3O2 and a molecular weight of 337.85 g/mol. Its IUPAC name is 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride
PubChem CID119388968
Molecular FormulaC17H24ClN3O2
Molecular Weight337.85 g/mol
Exact Mass337.16
IUPAC Name3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride
SMILESCC1CC1C(=O)Nc1cccc(C(=O)NC2CCNCC2)c1.Cl
InChIInChI=1S/C17H23N3O2.ClH/c1-11-9-15(11)17(22)20-14-4-2-3-12(10-14)16(21)19-13-5-7-18-8-6-13;/h2-4,10-11,13,15,18H,5-9H2,1H3,(H,19,21)(H,20,22);1H
InChIKeyJUCFVMSNANHTJJ-UHFFFAOYSA-N
XLogP2.18
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.85
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2-methylcyclopropanecarbonyl)amino]-N-(2-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120598473
N-cyclooctyl-3-[[(1S,2S)-2-methylcyclopropanecarbonyl]amino]benzamide
CID 39896916
N-(4-hydroxycyclohexyl)-3-[(2-methylcyclopropanecarbonyl)amino]benzamide
CID 110888559
3-[(2-methylcyclopropanecarbonyl)amino]-N-(2-pyrrolidin-3-ylethyl)benzamide
CID 119536660
N-piperidin-4-yl-3-(propan-2-ylcarbamoylamino)benzamide
CID 119387911
(2S,4S)-N-[3-(cyclopropylcarbamoyl)phenyl]-2-methylpiperidine-4-carboxamide
CID 120631994
trans-(1R,2R)-N-(3-acetylphenyl)-2-methylcyclopropane-1-carboxamide
CID 2111342
3-[(2-methylcyclopropanecarbonyl)amino]-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119463091
N-[3-(methylamino)propyl]-3-[(2-methylcyclopropanecarbonyl)amino]benzamide;hydrochloride
CID 119432738
N-[(4-hydroxypyrrolidin-3-yl)methyl]-3-[(2-methylcyclopropanecarbonyl)amino]benzamide;hydrochloride
CID 120948616
3-[(2-methylcyclopropanecarbonyl)amino]-N-(pyrrolidin-2-ylmethyl)benzamide
CID 119513177
N-[3-[[(3-chlorobenzoyl)amino]carbamoyl]phenyl]-2-methylcyclopropane-1-carboxamide
CID 46450403

Frequently Asked Questions

What is the IUPAC name of 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride?
The IUPAC name of 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride (CID 119388968) is 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride.
What is the SMILES notation for 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride?
The canonical SMILES for 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride is CC1CC1C(=O)Nc1cccc(C(=O)NC2CCNCC2)c1.Cl.
What is the InChIKey of 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride?
The InChIKey is JUCFVMSNANHTJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2.ClH/c1-11-9-15(11)17(22)20-14-4-2-3-12(10-14)16(21)19-13-5-7-18-8-6-13;/h2-4,10-11,13,15,18H,5-9H2,1H3,(H,19,21)(H,20,22);1H.
What are the key properties of 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride?
3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride has a molecular weight of 337.85 g/mol, XLogP of 2.18, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-methylcyclopropanecarbonyl)amino]-N-piperidin-4-ylbenzamide;hydrochloride is sourced from PubChem (CID 119388968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).