N-(3,4-dichlorophenyl)cyclopropanecarboxamide

C10H9Cl2NO — CID 17693

IUPACN-(3,4-dichlorophenyl)cyclopropanecarboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C1CC1
InChIInChI=1S/C10H9Cl2NO/c11-8-4-3-7(5-9(8)12)13-10(14)6-1-2-6/h3-6H,1-2H2,(H,13,14)
InChIKeyPLQDLOBGKJCDSZ-UHFFFAOYSA-N
MW230.09 g/mol
LogP3.34
Rot. Bonds2

About N-(3,4-dichlorophenyl)cyclopropanecarboxamide

N-(3,4-dichlorophenyl)cyclopropanecarboxamide (PubChem CID 17693) has the molecular formula C10H9Cl2NO and a molecular weight of 230.09 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)cyclopropanecarboxamide
PubChem CID17693
Molecular FormulaC10H9Cl2NO
Molecular Weight230.09 g/mol
Exact Mass229.01
IUPAC NameN-(3,4-dichlorophenyl)cyclopropanecarboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)C1CC1
InChIInChI=1S/C10H9Cl2NO/c11-8-4-3-7(5-9(8)12)13-10(14)6-1-2-6/h3-6H,1-2H2,(H,13,14)
InChIKeyPLQDLOBGKJCDSZ-UHFFFAOYSA-N
XLogP3.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.09
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)cyclopropanecarboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)cyclopropanecarboxamide (CID 17693) is N-(3,4-dichlorophenyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)cyclopropanecarboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)cyclopropanecarboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)C1CC1.
What is the InChIKey of N-(3,4-dichlorophenyl)cyclopropanecarboxamide?
The InChIKey is PLQDLOBGKJCDSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2NO/c11-8-4-3-7(5-9(8)12)13-10(14)6-1-2-6/h3-6H,1-2H2,(H,13,14).
What are the key properties of N-(3,4-dichlorophenyl)cyclopropanecarboxamide?
N-(3,4-dichlorophenyl)cyclopropanecarboxamide has a molecular weight of 230.09 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)cyclopropanecarboxamide is sourced from PubChem (CID 17693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).