N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide

C15H17ClN2O2 — CID 109131903

IUPACN-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)C1CC1C(=O)N1CCCC1
InChIInChI=1S/C15H17ClN2O2/c16-10-4-3-5-11(8-10)17-14(19)12-9-13(12)15(20)18-6-1-2-7-18/h3-5,8,12-13H,1-2,6-7,9H2,(H,17,19)
InChIKeyJBKHTEFCXXHWDG-UHFFFAOYSA-N
MW292.77 g/mol
LogP2.54
Rot. Bonds3

About N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide

N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide (PubChem CID 109131903) has the molecular formula C15H17ClN2O2 and a molecular weight of 292.77 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
PubChem CID109131903
Molecular FormulaC15H17ClN2O2
Molecular Weight292.77 g/mol
Exact Mass292.10
IUPAC NameN-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)C1CC1C(=O)N1CCCC1
InChIInChI=1S/C15H17ClN2O2/c16-10-4-3-5-11(8-10)17-14(19)12-9-13(12)15(20)18-6-1-2-7-18/h3-5,8,12-13H,1-2,6-7,9H2,(H,17,19)
InChIKeyJBKHTEFCXXHWDG-UHFFFAOYSA-N
XLogP2.54
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azepane-1-carbonyl)-N-(3-bromophenyl)cyclopropane-1-carboxamide
CID 109140751
N-(3,4-dichlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109131966
2-(azepane-1-carbonyl)-N-phenylcyclopropane-1-carboxamide
CID 109140677
1-N-(3-chlorophenyl)-2-N-phenylcyclopropane-1,2-dicarboxamide
CID 109140819
2-[(3-chlorophenyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 53270444
2-(azepane-1-carbonyl)-N-[3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
CID 109140728
methyl 3-[[2-(piperidine-1-carbonyl)cyclopropanecarbonyl]amino]benzoate
CID 109132315
N-[2-(3-chlorophenyl)ethyl]-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109131872
N-(4-chloro-2-methylphenyl)-2-(piperidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109132288
2-[4-[(3-chlorophenyl)carbamoyl]-1,4-diazepane-1-carbonyl]cyclobutane-1-carboxylic acid
CID 120975732
1-N-butan-2-yl-2-N-(3-chlorophenyl)cyclopropane-1,2-dicarboxamide
CID 109131711
2-(azepan-1-yl)-N-(3-chlorophenyl)-2-oxoacetamide
CID 47335488

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide (CID 109131903) is N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide is O=C(Nc1cccc(Cl)c1)C1CC1C(=O)N1CCCC1.
What is the InChIKey of N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide?
The InChIKey is JBKHTEFCXXHWDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O2/c16-10-4-3-5-11(8-10)17-14(19)12-9-13(12)15(20)18-6-1-2-7-18/h3-5,8,12-13H,1-2,6-7,9H2,(H,17,19).
What are the key properties of N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide?
N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide has a molecular weight of 292.77 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 109131903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).