1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide

C15H19ClN2O2 — CID 109130448

IUPAC1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide
SMILESCCCNC(=O)C1CC1C(=O)NCc1ccccc1Cl
InChIInChI=1S/C15H19ClN2O2/c1-2-7-17-14(19)11-8-12(11)15(20)18-9-10-5-3-4-6-13(10)16/h3-6,11-12H,2,7-9H2,1H3,(H,17,19)(H,18,20)
InChIKeyQDRVDLAAQLGELB-UHFFFAOYSA-N
MW294.78 g/mol
LogP2.12
Rot. Bonds6

About 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide

1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide (PubChem CID 109130448) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide
PubChem CID109130448
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC Name1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide
SMILESCCCNC(=O)C1CC1C(=O)NCc1ccccc1Cl
InChIInChI=1S/C15H19ClN2O2/c1-2-7-17-14(19)11-8-12(11)15(20)18-9-10-5-3-4-6-13(10)16/h3-6,11-12H,2,7-9H2,1H3,(H,17,19)(H,18,20)
InChIKeyQDRVDLAAQLGELB-UHFFFAOYSA-N
XLogP2.12
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-N-[(2-chlorophenyl)methyl]-1-N-(2-methylpropyl)cyclopropane-1,2-dicarboxamide
CID 109131432
2-N-[2-(4-chlorophenyl)ethyl]-1-N-[(2-chlorophenyl)methyl]cyclopropane-1,2-dicarboxamide
CID 109136180
4-N-[(2-chlorophenyl)methyl]-1-N-pentylcyclohexane-1,4-dicarboxamide
CID 109148482
N-[(2-chlorophenyl)methyl]cyclopropanecarboxamide
CID 899098
1-N-(2-phenylethyl)-2-N-propylcyclopropane-1,2-dicarboxamide
CID 109130457
2-N-[(2-chlorophenyl)methyl]-1-N-(3,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109136278
N-[(2-chlorophenyl)methyl]-2-(3-methylpiperidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109136195
2-N-[(2-chlorophenyl)methyl]-1-N-(4-propan-2-yloxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109136243
N-[(2-chlorophenyl)methyl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 44586596
N-[(2-chlorophenyl)methyl]cyclobutanecarboxamide
CID 17173308
2-N-[(2-chlorophenyl)methyl]-1-N-(2-methoxy-5-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109136241
N-[2-[(2-chlorophenyl)methylamino]ethyl]cyclopropanecarboxamide
CID 113218812

Frequently Asked Questions

What is the IUPAC name of 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide?
The IUPAC name of 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide (CID 109130448) is 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide?
The canonical SMILES for 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide is CCCNC(=O)C1CC1C(=O)NCc1ccccc1Cl.
What is the InChIKey of 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide?
The InChIKey is QDRVDLAAQLGELB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c1-2-7-17-14(19)11-8-12(11)15(20)18-9-10-5-3-4-6-13(10)16/h3-6,11-12H,2,7-9H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide?
1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide has a molecular weight of 294.78 g/mol, XLogP of 2.12, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[(2-chlorophenyl)methyl]-2-N-propylcyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109130448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).