N-but-1-en-2-ylbutanamide

C8H15NO — CID 159787043

IUPACN-but-1-en-2-ylbutanamide
SMILESC=C(CC)NC(=O)CCC
InChIInChI=1S/C8H15NO/c1-4-6-8(10)9-7(3)5-2/h3-6H2,1-2H3,(H,9,10)
InChIKeyNIBUCBFIDIYQEJ-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.83
Rot. Bonds4

About N-but-1-en-2-ylbutanamide

N-but-1-en-2-ylbutanamide (PubChem CID 159787043) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-but-1-en-2-ylbutanamide.

Molecular Properties

Compound NameN-but-1-en-2-ylbutanamide
PubChem CID159787043
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-but-1-en-2-ylbutanamide
SMILESC=C(CC)NC(=O)CCC
InChIInChI=1S/C8H15NO/c1-4-6-8(10)9-7(3)5-2/h3-6H2,1-2H3,(H,9,10)
InChIKeyNIBUCBFIDIYQEJ-UHFFFAOYSA-N
XLogP1.83
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(methylcarbamoyl)butanamide
CID 12936929
N-butanoylcyclopropanecarboxamide
CID 89311157
N-(propylcarbamoyl)butanamide
CID 12936931
(E)-N-but-1-en-2-yl-2-methylbut-2-enamide
CID 166829652
2-(pentanoylamino)prop-2-enoic acid
CID 87954179
N-sulfanylbutanamide
CID 18680505
4-methylideneheptan-3-one
CID 13485259
1-N'-but-1-en-2-ylethene-1,1-diamine
CID 166131853
N-ethylbutanamide;methanimine
CID 142280316
N-[(butanoylamino)tetrasulfanyl]butanamide
CID 139729508
N-prop-1-en-2-ylheptanamide
CID 89354267
tris(butan-2-one);tris(pentan-2-one)
CID 157203121

Frequently Asked Questions

What is the IUPAC name of N-but-1-en-2-ylbutanamide?
The IUPAC name of N-but-1-en-2-ylbutanamide (CID 159787043) is N-but-1-en-2-ylbutanamide.
What is the SMILES notation for N-but-1-en-2-ylbutanamide?
The canonical SMILES for N-but-1-en-2-ylbutanamide is C=C(CC)NC(=O)CCC.
What is the InChIKey of N-but-1-en-2-ylbutanamide?
The InChIKey is NIBUCBFIDIYQEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-6-8(10)9-7(3)5-2/h3-6H2,1-2H3,(H,9,10).
What are the key properties of N-but-1-en-2-ylbutanamide?
N-but-1-en-2-ylbutanamide has a molecular weight of 141.21 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-1-en-2-ylbutanamide is sourced from PubChem (CID 159787043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).