1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide

C14H20N2O — CID 65463970

IUPAC1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)C1(N)CC1
InChIInChI=1S/C14H20N2O/c1-3-10-6-5-7-11(4-2)12(10)16-13(17)14(15)8-9-14/h5-7H,3-4,8-9,15H2,1-2H3,(H,16,17)
InChIKeyGOTAGQGBNSTDEN-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.24
Rot. Bonds4

About 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide

1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide (PubChem CID 65463970) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide
PubChem CID65463970
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)C1(N)CC1
InChIInChI=1S/C14H20N2O/c1-3-10-6-5-7-11(4-2)12(10)16-13(17)14(15)8-9-14/h5-7H,3-4,8-9,15H2,1-2H3,(H,16,17)
InChIKeyGOTAGQGBNSTDEN-UHFFFAOYSA-N
XLogP2.24
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide (CID 65463970) is 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide is CCc1cccc(CC)c1NC(=O)C1(N)CC1.
What is the InChIKey of 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide?
The InChIKey is GOTAGQGBNSTDEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-3-10-6-5-7-11(4-2)12(10)16-13(17)14(15)8-9-14/h5-7H,3-4,8-9,15H2,1-2H3,(H,16,17).
What are the key properties of 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide?
1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2,6-diethylphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 65463970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).