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

C9H15NO — CID 118166293

IUPACN,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide
SMILESC=CCC1(C(=O)N(C)C)CC1
InChIInChI=1S/C9H15NO/c1-4-5-9(6-7-9)8(11)10(2)3/h4H,1,5-7H2,2-3H3
InChIKeyVVQLVJIBAZNLAO-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.43
Rot. Bonds3

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

N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide (PubChem CID 118166293) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide
PubChem CID118166293
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide
SMILESC=CCC1(C(=O)N(C)C)CC1
InChIInChI=1S/C9H15NO/c1-4-5-9(6-7-9)8(11)10(2)3/h4H,1,5-7H2,2-3H3
InChIKeyVVQLVJIBAZNLAO-UHFFFAOYSA-N
XLogP1.43
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.43
H-Bond Donors ≤ 50
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 N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide?
The IUPAC name of N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide (CID 118166293) is N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide?
The canonical SMILES for N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide is C=CCC1(C(=O)N(C)C)CC1.
What is the InChIKey of N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide?
The InChIKey is VVQLVJIBAZNLAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-4-5-9(6-7-9)8(11)10(2)3/h4H,1,5-7H2,2-3H3.
What are the key properties of N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide?
N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide has a molecular weight of 153.22 g/mol, XLogP of 1.43, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-prop-2-enylcyclopropane-1-carboxamide is sourced from PubChem (CID 118166293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).