N-methyl-N-prop-2-enylpentanamide

C9H17NO — CID 135391089

IUPACN-methyl-N-prop-2-enylpentanamide
SMILESC=CCN(C)C(=O)CCCC
InChIInChI=1S/C9H17NO/c1-4-6-7-9(11)10(3)8-5-2/h5H,2,4,6-8H2,1,3H3
InChIKeyBDWOZPWMWYCADD-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.82
Rot. Bonds5

About N-methyl-N-prop-2-enylpentanamide

N-methyl-N-prop-2-enylpentanamide (PubChem CID 135391089) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-methyl-N-prop-2-enylpentanamide.

Molecular Properties

Compound NameN-methyl-N-prop-2-enylpentanamide
PubChem CID135391089
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-methyl-N-prop-2-enylpentanamide
SMILESC=CCN(C)C(=O)CCCC
InChIInChI=1S/C9H17NO/c1-4-6-7-9(11)10(3)8-5-2/h5H,2,4,6-8H2,1,3H3
InChIKeyBDWOZPWMWYCADD-UHFFFAOYSA-N
XLogP1.82
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.82
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-methyl-N-prop-2-enylpentanamide?
The IUPAC name of N-methyl-N-prop-2-enylpentanamide (CID 135391089) is N-methyl-N-prop-2-enylpentanamide.
What is the SMILES notation for N-methyl-N-prop-2-enylpentanamide?
The canonical SMILES for N-methyl-N-prop-2-enylpentanamide is C=CCN(C)C(=O)CCCC.
What is the InChIKey of N-methyl-N-prop-2-enylpentanamide?
The InChIKey is BDWOZPWMWYCADD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-4-6-7-9(11)10(3)8-5-2/h5H,2,4,6-8H2,1,3H3.
What are the key properties of N-methyl-N-prop-2-enylpentanamide?
N-methyl-N-prop-2-enylpentanamide has a molecular weight of 155.24 g/mol, XLogP of 1.82, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-prop-2-enylpentanamide is sourced from PubChem (CID 135391089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).