N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride

C17H24ClN3O2 — CID 120601523

IUPACN-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride
SMILESCC1CC(NC(=O)c2cccc(N3CCCC3=O)c2)CCN1.Cl
InChIInChI=1S/C17H23N3O2.ClH/c1-12-10-14(7-8-18-12)19-17(22)13-4-2-5-15(11-13)20-9-3-6-16(20)21;/h2,4-5,11-12,14,18H,3,6-10H2,1H3,(H,19,22);1H
InChIKeyCZPOXOLYIYUDMY-UHFFFAOYSA-N
MW337.85 g/mol
LogP2.11
Rot. Bonds3

About N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride

N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride (PubChem CID 120601523) has the molecular formula C17H24ClN3O2 and a molecular weight of 337.85 g/mol. Its IUPAC name is N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride
PubChem CID120601523
Molecular FormulaC17H24ClN3O2
Molecular Weight337.85 g/mol
Exact Mass337.16
IUPAC NameN-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride
SMILESCC1CC(NC(=O)c2cccc(N3CCCC3=O)c2)CCN1.Cl
InChIInChI=1S/C17H23N3O2.ClH/c1-12-10-14(7-8-18-12)19-17(22)13-4-2-5-15(11-13)20-9-3-6-16(20)21;/h2,4-5,11-12,14,18H,3,6-10H2,1H3,(H,19,22);1H
InChIKeyCZPOXOLYIYUDMY-UHFFFAOYSA-N
XLogP2.11
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.85
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride
CID 119456952
N-cyclooctyl-3-(2-oxopyrrolidin-1-yl)benzamide
CID 4229482
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 119456953
3-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]azetidine-1-carboxamide
CID 146022903
N-(1-cyclopropylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 86921682
N-(2-methylcyclohexyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 4063191
N-(2-methylpiperidin-4-yl)-3-(tetrazol-1-yl)benzamide;hydrochloride
CID 120601332
3-chloro-N-(2-methylpiperidin-4-yl)benzamide;hydrochloride
CID 120602026
N-(2-methylpiperidin-4-yl)-3-(trifluoromethyl)benzamide
CID 106995588
3-N,3-N-dimethyl-1-N-(2-methylpiperidin-4-yl)benzene-1,3-dicarboxamide;hydrochloride
CID 120599313
3-bromo-N-(2-methylpiperidin-4-yl)benzamide
CID 106995558
N-[(3S)-1-benzylpyrrolidin-3-yl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 40952996

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride?
The IUPAC name of N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride (CID 120601523) is N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride.
What is the SMILES notation for N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride?
The canonical SMILES for N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride is CC1CC(NC(=O)c2cccc(N3CCCC3=O)c2)CCN1.Cl.
What is the InChIKey of N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride?
The InChIKey is CZPOXOLYIYUDMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2.ClH/c1-12-10-14(7-8-18-12)19-17(22)13-4-2-5-15(11-13)20-9-3-6-16(20)21;/h2,4-5,11-12,14,18H,3,6-10H2,1H3,(H,19,22);1H.
What are the key properties of N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride?
N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride has a molecular weight of 337.85 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpiperidin-4-yl)-3-(2-oxopyrrolidin-1-yl)benzamide;hydrochloride is sourced from PubChem (CID 120601523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).