N-ethenyl-N-propan-2-ylbutanamide

C9H17NO — CID 87389097

IUPACN-ethenyl-N-propan-2-ylbutanamide
SMILESC=CN(C(=O)CCC)C(C)C
InChIInChI=1S/C9H17NO/c1-5-7-9(11)10(6-2)8(3)4/h6,8H,2,5,7H2,1,3-4H3
InChIKeyISEPUZIILHQNGZ-UHFFFAOYSA-N
MW155.24 g/mol
LogP2.17
Rot. Bonds4

About N-ethenyl-N-propan-2-ylbutanamide

N-ethenyl-N-propan-2-ylbutanamide (PubChem CID 87389097) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-ethenyl-N-propan-2-ylbutanamide.

Molecular Properties

Compound NameN-ethenyl-N-propan-2-ylbutanamide
PubChem CID87389097
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-ethenyl-N-propan-2-ylbutanamide
SMILESC=CN(C(=O)CCC)C(C)C
InChIInChI=1S/C9H17NO/c1-5-7-9(11)10(6-2)8(3)4/h6,8H,2,5,7H2,1,3-4H3
InChIKeyISEPUZIILHQNGZ-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

N-ethenyl-N-propan-2-yldecanamide
CID 87389049
N'-ethenyl-N'-propan-2-ylpentanediamide
CID 59324613
N-ethenyl-N-propan-2-ylpropanimidamide
CID 146638834
1-ethenyl-3-methyl-1,3-di(propan-2-yl)urea
CID 166800460
N-[1-[acetyl(ethenyl)amino]propyl]-N-ethenylacetamide
CID 56990592
2-methylidene-N,N-di(propan-2-yl)pentanamide
CID 87269106
N-formyl-N-methoxybutanamide
CID 89360816
N,N-dibromobutanamide
CID 154147629
N,N-dimethylbutanamide;hydrochloride
CID 87498306
2-[butanoyl(prop-2-enyl)amino]acetic acid
CID 79257484
N-(3-aminopropyl)-N-propan-2-ylbutanamide
CID 43136655
N-(3-bromopropyl)-N-propan-2-ylbutanamide
CID 80662184

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N-propan-2-ylbutanamide?
The IUPAC name of N-ethenyl-N-propan-2-ylbutanamide (CID 87389097) is N-ethenyl-N-propan-2-ylbutanamide.
What is the SMILES notation for N-ethenyl-N-propan-2-ylbutanamide?
The canonical SMILES for N-ethenyl-N-propan-2-ylbutanamide is C=CN(C(=O)CCC)C(C)C.
What is the InChIKey of N-ethenyl-N-propan-2-ylbutanamide?
The InChIKey is ISEPUZIILHQNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-5-7-9(11)10(6-2)8(3)4/h6,8H,2,5,7H2,1,3-4H3.
What are the key properties of N-ethenyl-N-propan-2-ylbutanamide?
N-ethenyl-N-propan-2-ylbutanamide 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-ethenyl-N-propan-2-ylbutanamide is sourced from PubChem (CID 87389097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).