2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide

C9H15NO — CID 103837190

IUPAC2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide
SMILESC=CCNC(=O)C1CC1(C)C
InChIInChI=1S/C9H15NO/c1-4-5-10-8(11)7-6-9(7,2)3/h4,7H,1,5-6H2,2-3H3,(H,10,11)
InChIKeyAROWJMAZYOPYSU-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.33
Rot. Bonds3

About 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide

2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide (PubChem CID 103837190) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide
PubChem CID103837190
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide
SMILESC=CCNC(=O)C1CC1(C)C
InChIInChI=1S/C9H15NO/c1-4-5-10-8(11)7-6-9(7,2)3/h4,7H,1,5-6H2,2-3H3,(H,10,11)
InChIKeyAROWJMAZYOPYSU-UHFFFAOYSA-N
XLogP1.33
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide?
The IUPAC name of 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide (CID 103837190) is 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide.
What is the SMILES notation for 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide?
The canonical SMILES for 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide is C=CCNC(=O)C1CC1(C)C.
What is the InChIKey of 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide?
The InChIKey is AROWJMAZYOPYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-4-5-10-8(11)7-6-9(7,2)3/h4,7H,1,5-6H2,2-3H3,(H,10,11).
What are the key properties of 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide?
2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide has a molecular weight of 153.22 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide is sourced from PubChem (CID 103837190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).