N,3-dimethyl-2-propylpent-2-enamide

C10H19NO — CID 175801698

IUPACN,3-dimethyl-2-propylpent-2-enamide
SMILESCCCC(C(=O)NC)=C(C)CC
InChIInChI=1S/C10H19NO/c1-5-7-9(8(3)6-2)10(12)11-4/h5-7H2,1-4H3,(H,11,12)
InChIKeyBXBYTGBGXBFNTE-UHFFFAOYSA-N
MW169.27 g/mol
LogP2.26
Rot. Bonds4

About N,3-dimethyl-2-propylpent-2-enamide

N,3-dimethyl-2-propylpent-2-enamide (PubChem CID 175801698) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N,3-dimethyl-2-propylpent-2-enamide.

Molecular Properties

Compound NameN,3-dimethyl-2-propylpent-2-enamide
PubChem CID175801698
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN,3-dimethyl-2-propylpent-2-enamide
SMILESCCCC(C(=O)NC)=C(C)CC
InChIInChI=1S/C10H19NO/c1-5-7-9(8(3)6-2)10(12)11-4/h5-7H2,1-4H3,(H,11,12)
InChIKeyBXBYTGBGXBFNTE-UHFFFAOYSA-N
XLogP2.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

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CID 174850650
N-hydroxypropanamide;N-methylbutanamide
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(E)-N,4-dimethylhept-3-en-3-amine
CID 170734903
2-butan-2-ylideneoctanoic acid
CID 173391437
heptane-2,4-dione;palladium(2+)
CID 21417766
butanoate;N-methylacetamide
CID 23457257
(E)-3-methyl-2-(methylaminomethyl)-N-propan-2-ylpent-2-enamide
CID 163399698
5-amino-N-methyl-2-propan-2-ylidenepentanamide
CID 156782224
N,N'-di((113C)methyl)oxamide
CID 169438737
tris(butan-2-one);tris(pentan-2-one)
CID 157203121

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-2-propylpent-2-enamide?
The IUPAC name of N,3-dimethyl-2-propylpent-2-enamide (CID 175801698) is N,3-dimethyl-2-propylpent-2-enamide.
What is the SMILES notation for N,3-dimethyl-2-propylpent-2-enamide?
The canonical SMILES for N,3-dimethyl-2-propylpent-2-enamide is CCCC(C(=O)NC)=C(C)CC.
What is the InChIKey of N,3-dimethyl-2-propylpent-2-enamide?
The InChIKey is BXBYTGBGXBFNTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-5-7-9(8(3)6-2)10(12)11-4/h5-7H2,1-4H3,(H,11,12).
What are the key properties of N,3-dimethyl-2-propylpent-2-enamide?
N,3-dimethyl-2-propylpent-2-enamide has a molecular weight of 169.27 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-2-propylpent-2-enamide is sourced from PubChem (CID 175801698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).