(Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide

C14H19NO — CID 142370556

IUPAC(Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide
SMILESC/C=C(/CC(C)C(N)=O)c1ccccc1C
InChIInChI=1S/C14H19NO/c1-4-12(9-11(3)14(15)16)13-8-6-5-7-10(13)2/h4-8,11H,9H2,1-3H3,(H2,15,16)/b12-4-
InChIKeyDEVFIVWJQJOFBE-QCDXTXTGSA-N
MW217.31 g/mol
LogP2.91
Rot. Bonds4

About (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide

(Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide (PubChem CID 142370556) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide.

Molecular Properties

Compound Name(Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide
PubChem CID142370556
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name(Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide
SMILESC/C=C(/CC(C)C(N)=O)c1ccccc1C
InChIInChI=1S/C14H19NO/c1-4-12(9-11(3)14(15)16)13-8-6-5-7-10(13)2/h4-8,11H,9H2,1-3H3,(H2,15,16)/b12-4-
InChIKeyDEVFIVWJQJOFBE-QCDXTXTGSA-N
XLogP2.91
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(Z,2S)-2-azido-4-(2-methylphenyl)hex-4-enamide
CID 146276257
(5Z)-N-ethyl-3-methyl-5-(2-methylphenyl)hepta-1,5-dien-2-amine
CID 171560882
2-methylbenzamide;molecular hydrogen
CID 177161283
2-methyl-3-(2-methylphenyl)-3-oxopropanamide
CID 121217093
(3-amino-2-methyl-3-oxopropyl) 2-amino-3-methylbenzoate
CID 61322087
(Z)-1-(2-methylphenyl)prop-1-en-1-amine
CID 126678655
3-(2-methylphenyl)-3-oxo-2-phenylpropanamide
CID 174882127
(Z)-N,N-dimethyl-3-(2-methylphenyl)pent-3-en-1-amine
CID 167306993
[(2R)-4-methoxy-4-oxobutan-2-yl] 2-methylbenzoate
CID 75506552
4-hydroxy-2-methyl-4-(2-methylphenyl)butanamide
CID 174318100
2-amino-2-methyl-N-[(Z)-3-(2-methylphenyl)pent-3-enyl]propanamide
CID 71216786
2-methylbenzamide;phenol
CID 160508327

Frequently Asked Questions

What is the IUPAC name of (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide?
The IUPAC name of (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide (CID 142370556) is (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide.
What is the SMILES notation for (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide?
The canonical SMILES for (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide is C/C=C(/CC(C)C(N)=O)c1ccccc1C.
What is the InChIKey of (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide?
The InChIKey is DEVFIVWJQJOFBE-QCDXTXTGSA-N. The full InChI is InChI=1S/C14H19NO/c1-4-12(9-11(3)14(15)16)13-8-6-5-7-10(13)2/h4-8,11H,9H2,1-3H3,(H2,15,16)/b12-4-.
What are the key properties of (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide?
(Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide has a molecular weight of 217.31 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-methyl-4-(2-methylphenyl)hex-4-enamide is sourced from PubChem (CID 142370556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).