N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide

C8H16N2O — CID 135161197

IUPACN-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide
SMILESCCCC(=O)N/C(C)=C\NC
InChIInChI=1S/C8H16N2O/c1-4-5-8(11)10-7(2)6-9-3/h6,9H,4-5H2,1-3H3,(H,10,11)/b7-6-
InChIKeyUHLZZGSKZLDYKC-SREVYHEPSA-N
MW156.23 g/mol
LogP0.98
Rot. Bonds4

About N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide

N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide (PubChem CID 135161197) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide.

Molecular Properties

Compound NameN-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide
PubChem CID135161197
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide
SMILESCCCC(=O)N/C(C)=C\NC
InChIInChI=1S/C8H16N2O/c1-4-5-8(11)10-7(2)6-9-3/h6,9H,4-5H2,1-3H3,(H,10,11)/b7-6-
InChIKeyUHLZZGSKZLDYKC-SREVYHEPSA-N
XLogP0.98
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide?
The IUPAC name of N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide (CID 135161197) is N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide.
What is the SMILES notation for N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide?
The canonical SMILES for N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide is CCCC(=O)N/C(C)=C\NC.
What is the InChIKey of N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide?
The InChIKey is UHLZZGSKZLDYKC-SREVYHEPSA-N. The full InChI is InChI=1S/C8H16N2O/c1-4-5-8(11)10-7(2)6-9-3/h6,9H,4-5H2,1-3H3,(H,10,11)/b7-6-.
What are the key properties of N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide?
N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide has a molecular weight of 156.23 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(methylamino)prop-1-en-2-yl]butanamide is sourced from PubChem (CID 135161197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).