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

C12H15ClN2O2 — CID 65463820

IUPAC1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide
SMILESCCOc1ccc(Cl)cc1NC(=O)C1(N)CC1
InChIInChI=1S/C12H15ClN2O2/c1-2-17-10-4-3-8(13)7-9(10)15-11(16)12(14)5-6-12/h3-4,7H,2,5-6,14H2,1H3,(H,15,16)
InChIKeyWNXUYJZNTHRLGI-UHFFFAOYSA-N
MW254.72 g/mol
LogP2.17
Rot. Bonds4

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

1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide (PubChem CID 65463820) has the molecular formula C12H15ClN2O2 and a molecular weight of 254.72 g/mol. Its IUPAC name is 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide
PubChem CID65463820
Molecular FormulaC12H15ClN2O2
Molecular Weight254.72 g/mol
Exact Mass254.08
IUPAC Name1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide
SMILESCCOc1ccc(Cl)cc1NC(=O)C1(N)CC1
InChIInChI=1S/C12H15ClN2O2/c1-2-17-10-4-3-8(13)7-9(10)15-11(16)12(14)5-6-12/h3-4,7H,2,5-6,14H2,1H3,(H,15,16)
InChIKeyWNXUYJZNTHRLGI-UHFFFAOYSA-N
XLogP2.17
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.72
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-(2-ethoxyphenyl)cyclopropane-1-carboxamide
CID 65463762
1-amino-N-(5-chloro-2-methylphenyl)cyclopropane-1-carboxamide
CID 65465047
3-amino-N-(5-chloro-2-ethoxyphenyl)propanamide
CID 60927898
3-amino-N-(5-chloro-2-ethoxyphenyl)-3-methylbutanamide
CID 64683487
N-(5-chloro-2-ethoxyphenyl)butanamide
CID 61062519
1-(4-chlorophenyl)-N-(2,5-diethoxyphenyl)cyclopropane-1-carboxamide
CID 112765724
1-N'-(5-chloro-2-methylphenyl)-1-N-(2-ethoxyphenyl)cyclopropane-1,1-dicarboxamide
CID 108982689
2,4-dichloro-N-(5-chloro-2-ethoxyphenyl)benzamide
CID 4779142
4-chloro-N-(5-chloro-2-ethoxyphenyl)butanamide
CID 63308071
N-(5-chloro-2-ethoxyphenyl)-2-methoxypropanamide
CID 112685938
2-amino-N-(5-chloro-2-ethoxyphenyl)-4-methylpentanamide
CID 54862650
1-amino-N-(3-chloro-4-ethoxyphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119285029

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide (CID 65463820) is 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide is CCOc1ccc(Cl)cc1NC(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide?
The InChIKey is WNXUYJZNTHRLGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O2/c1-2-17-10-4-3-8(13)7-9(10)15-11(16)12(14)5-6-12/h3-4,7H,2,5-6,14H2,1H3,(H,15,16).
What are the key properties of 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide?
1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide has a molecular weight of 254.72 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(5-chloro-2-ethoxyphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 65463820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).