2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide

C10H17NO — CID 104952912

IUPAC2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide
SMILESC=C(C)CNC(=O)C1CC1(C)C
InChIInChI=1S/C10H17NO/c1-7(2)6-11-9(12)8-5-10(8,3)4/h8H,1,5-6H2,2-4H3,(H,11,12)
InChIKeyLVCYBZRYDOTECF-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.72
Rot. Bonds3

About 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide

2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide (PubChem CID 104952912) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide
PubChem CID104952912
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide
SMILESC=C(C)CNC(=O)C1CC1(C)C
InChIInChI=1S/C10H17NO/c1-7(2)6-11-9(12)8-5-10(8,3)4/h8H,1,5-6H2,2-4H3,(H,11,12)
InChIKeyLVCYBZRYDOTECF-UHFFFAOYSA-N
XLogP1.72
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide?
The IUPAC name of 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide (CID 104952912) is 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide?
The canonical SMILES for 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide is C=C(C)CNC(=O)C1CC1(C)C.
What is the InChIKey of 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide?
The InChIKey is LVCYBZRYDOTECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-7(2)6-11-9(12)8-5-10(8,3)4/h8H,1,5-6H2,2-4H3,(H,11,12).
What are the key properties of 2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide?
2,2-dimethyl-N-(2-methylprop-2-enyl)cyclopropane-1-carboxamide has a molecular weight of 167.25 g/mol, XLogP of 1.72, 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-(2-methylprop-2-enyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 104952912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).