N,N,2-trimethyl-3-phenylpent-4-enamide

C14H19NO — CID 132648038

IUPACN,N,2-trimethyl-3-phenylpent-4-enamide
SMILESC=CC(c1ccccc1)C(C)C(=O)N(C)C
InChIInChI=1S/C14H19NO/c1-5-13(11(2)14(16)15(3)4)12-9-7-6-8-10-12/h5-11,13H,1H2,2-4H3
InChIKeyCOVRYFFQTPGJAR-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.68
Rot. Bonds4

About N,N,2-trimethyl-3-phenylpent-4-enamide

N,N,2-trimethyl-3-phenylpent-4-enamide (PubChem CID 132648038) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is N,N,2-trimethyl-3-phenylpent-4-enamide.

Molecular Properties

Compound NameN,N,2-trimethyl-3-phenylpent-4-enamide
PubChem CID132648038
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC NameN,N,2-trimethyl-3-phenylpent-4-enamide
SMILESC=CC(c1ccccc1)C(C)C(=O)N(C)C
InChIInChI=1S/C14H19NO/c1-5-13(11(2)14(16)15(3)4)12-9-7-6-8-10-12/h5-11,13H,1H2,2-4H3
InChIKeyCOVRYFFQTPGJAR-UHFFFAOYSA-N
XLogP2.68
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-methyl-3-phenylpent-4-enoic acid
CID 70506498
(2R,3S)-N,N-diethyl-2-methyl-3-phenylpent-4-enamide
CID 134922582
3-(3-methoxyphenyl)-N,N,2-trimethylpent-4-enamide
CID 118204455
N,N-dimethyl-2,2-diphenylacetamide;prop-2-enoic acid
CID 70599028
N,N-dimethyl-2,2-diphenylacetamide
CID 19693860
[(1R,2S)-1-ethenyl-2-phenylbut-3-enyl]benzene
CID 12573330
N,N-dimethyl-2,2-diphenylacetamide;ethane
CID 67314826
bis(N,N-dimethyl-2,2-diphenylacetamide);sulfane
CID 89402051
N-benzyl-N-ethyl-3-(3-hydroxyphenyl)-2-methylpent-4-enamide
CID 118204481
(2R,3R)-3-(3-methoxyphenyl)-2-methylpent-4-enoic acid
CID 118204888
(1-hydroxy-1-phenylbut-3-en-2-yl) N,N-dimethylcarbamate
CID 102469609
(2S)-2-amino-N,N-dimethyl-2-phenylacetamide
CID 11263835

Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-3-phenylpent-4-enamide?
The IUPAC name of N,N,2-trimethyl-3-phenylpent-4-enamide (CID 132648038) is N,N,2-trimethyl-3-phenylpent-4-enamide.
What is the SMILES notation for N,N,2-trimethyl-3-phenylpent-4-enamide?
The canonical SMILES for N,N,2-trimethyl-3-phenylpent-4-enamide is C=CC(c1ccccc1)C(C)C(=O)N(C)C.
What is the InChIKey of N,N,2-trimethyl-3-phenylpent-4-enamide?
The InChIKey is COVRYFFQTPGJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-5-13(11(2)14(16)15(3)4)12-9-7-6-8-10-12/h5-11,13H,1H2,2-4H3.
What are the key properties of N,N,2-trimethyl-3-phenylpent-4-enamide?
N,N,2-trimethyl-3-phenylpent-4-enamide has a molecular weight of 217.31 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-3-phenylpent-4-enamide is sourced from PubChem (CID 132648038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).