1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide

C11H13ClN2O — CID 65465047

IUPAC1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)C1(N)CC1
InChIInChI=1S/C11H13ClN2O/c1-7-2-3-8(12)6-9(7)14-10(15)11(13)4-5-11/h2-3,6H,4-5,13H2,1H3,(H,14,15)
InChIKeyRSVFVMCGIREGCY-UHFFFAOYSA-N
MW224.69 g/mol
LogP2.08
Rot. Bonds2

About 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide

1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide (PubChem CID 65465047) has the molecular formula C11H13ClN2O and a molecular weight of 224.69 g/mol. Its IUPAC name is 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide
PubChem CID65465047
Molecular FormulaC11H13ClN2O
Molecular Weight224.69 g/mol
Exact Mass224.07
IUPAC Name1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)C1(N)CC1
InChIInChI=1S/C11H13ClN2O/c1-7-2-3-8(12)6-9(7)14-10(15)11(13)4-5-11/h2-3,6H,4-5,13H2,1H3,(H,14,15)
InChIKeyRSVFVMCGIREGCY-UHFFFAOYSA-N
XLogP2.08
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.69
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide
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1-amino-N-[5-[(dimethylamino)methyl]-2-methylphenyl]cyclopropane-1-carboxamide;dihydrochloride
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N-(5-chloro-2-methylphenyl)-1-phenylcyclobutane-1-carboxamide
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1-N'-(5-chloro-2-methylphenyl)-1-N-cyclopropylcyclopropane-1,1-dicarboxamide
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1-amino-N-(5-chloro-4-methoxy-2-methylphenyl)cyclopropane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide (CID 65465047) is 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide is Cc1ccc(Cl)cc1NC(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide?
The InChIKey is RSVFVMCGIREGCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O/c1-7-2-3-8(12)6-9(7)14-10(15)11(13)4-5-11/h2-3,6H,4-5,13H2,1H3,(H,14,15).
What are the key properties of 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide?
1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide has a molecular weight of 224.69 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 65465047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).