N-butyl-N-prop-1-enylacetamide

C9H17NO — CID 54345806

IUPACN-butyl-N-prop-1-enylacetamide
SMILESCC=CN(CCCC)C(C)=O
InChIInChI=1S/C9H17NO/c1-4-6-8-10(7-5-2)9(3)11/h5,7H,4,6,8H2,1-3H3
InChIKeyUCGBGNHRBURHON-UHFFFAOYSA-N
MW155.24 g/mol
LogP2.17
Rot. Bonds4

About N-butyl-N-prop-1-enylacetamide

N-butyl-N-prop-1-enylacetamide (PubChem CID 54345806) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-butyl-N-prop-1-enylacetamide.

Molecular Properties

Compound NameN-butyl-N-prop-1-enylacetamide
PubChem CID54345806
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-butyl-N-prop-1-enylacetamide
SMILESCC=CN(CCCC)C(C)=O
InChIInChI=1S/C9H17NO/c1-4-6-8-10(7-5-2)9(3)11/h5,7H,4,6,8H2,1-3H3
InChIKeyUCGBGNHRBURHON-UHFFFAOYSA-N
XLogP2.17
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 18767604
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(Z)-N-formyl-N-pentylbut-2-enamide
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N-butyl-N-heptylacetamide
CID 91713167
N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide
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N-(8-methylideneoctadecyl)-N-(8-methylnon-8-enyl)-N'-[(Z)-prop-1-enyl]-N'-prop-1-en-2-ylpropane-1,3-diamine
CID 170031345
(dibutylamino) 2-methylbut-2-enoate
CID 174778974
N-butyl-N-methylsulfonylacetamide
CID 45377177
N-(2-bromoethyl)-N-butylacetamide
CID 80659482
N,N-di(pentadecyl)acetamide
CID 174726671
N-acetyl-N-decylacetamide
CID 57029087

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-prop-1-enylacetamide?
The IUPAC name of N-butyl-N-prop-1-enylacetamide (CID 54345806) is N-butyl-N-prop-1-enylacetamide.
What is the SMILES notation for N-butyl-N-prop-1-enylacetamide?
The canonical SMILES for N-butyl-N-prop-1-enylacetamide is CC=CN(CCCC)C(C)=O.
What is the InChIKey of N-butyl-N-prop-1-enylacetamide?
The InChIKey is UCGBGNHRBURHON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-4-6-8-10(7-5-2)9(3)11/h5,7H,4,6,8H2,1-3H3.
What are the key properties of N-butyl-N-prop-1-enylacetamide?
N-butyl-N-prop-1-enylacetamide has a molecular weight of 155.24 g/mol, XLogP of 2.17, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-prop-1-enylacetamide is sourced from PubChem (CID 54345806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).