2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride

C15H21ClN2O — CID 119453095

IUPAC2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride
SMILESCc1ccccc1C1CC1C(=O)NC1CCNC1.Cl
InChIInChI=1S/C15H20N2O.ClH/c1-10-4-2-3-5-12(10)13-8-14(13)15(18)17-11-6-7-16-9-11;/h2-5,11,13-14,16H,6-9H2,1H3,(H,17,18);1H
InChIKeyWTCVMZSBKCQHRL-UHFFFAOYSA-N
MW280.80 g/mol
LogP2.00
Rot. Bonds3

About 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride

2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride (PubChem CID 119453095) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride
PubChem CID119453095
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC Name2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride
SMILESCc1ccccc1C1CC1C(=O)NC1CCNC1.Cl
InChIInChI=1S/C15H20N2O.ClH/c1-10-4-2-3-5-12(10)13-8-14(13)15(18)17-11-6-7-16-9-11;/h2-5,11,13-14,16H,6-9H2,1H3,(H,17,18);1H
InChIKeyWTCVMZSBKCQHRL-UHFFFAOYSA-N
XLogP2.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-naphthalen-1-yl-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride
CID 119454446
N-pyrrolidin-3-yl-2-[2-(trifluoromethoxy)phenyl]cyclopropane-1-carboxamide
CID 119449909
trans-(1R,2R)-2-(2-methylphenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)cyclopropane-1-carboxamide
CID 167824410
N-cyclopropyl-3-[[2-(2-methylphenyl)cyclopropanecarbonyl]amino]cyclohexane-1-carboxamide
CID 71930187
2-(2,6-difluorophenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride
CID 119451294
methyl 3-(2-methylphenyl)piperidine-4-carboxylate;hydrochloride
CID 91798782
2-(2,3-dichlorophenyl)-N-piperidin-4-ylcyclopropane-1-carboxamide
CID 119386183
4-(2-methylphenyl)piperidine-3-carboxylate
CID 23157120
2-(3,5-dichlorophenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride
CID 119449999
trans-(1R,2R)-2-[[(1S,2R)-2-(2-methylphenyl)cyclopropanecarbonyl]amino]cyclohexane-1-carboxamide
CID 124779575
3-N-cyclopropyl-1-N-ethyl-4-(2-methylphenyl)pyrrolidine-1,3-dicarboxamide
CID 42828595
3-(2-methylphenyl)piperidin-4-ol
CID 117168026

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride (CID 119453095) is 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride is Cc1ccccc1C1CC1C(=O)NC1CCNC1.Cl.
What is the InChIKey of 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride?
The InChIKey is WTCVMZSBKCQHRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O.ClH/c1-10-4-2-3-5-12(10)13-8-14(13)15(18)17-11-6-7-16-9-11;/h2-5,11,13-14,16H,6-9H2,1H3,(H,17,18);1H.
What are the key properties of 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride?
2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride has a molecular weight of 280.80 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-N-pyrrolidin-3-ylcyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119453095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).