(E)-2-(dimethylamino)-4-methyloct-6-enamide

C11H22N2O — CID 144611499

IUPAC(E)-2-(dimethylamino)-4-methyloct-6-enamide
SMILESC/C=C/CC(C)CC(C(N)=O)N(C)C
InChIInChI=1S/C11H22N2O/c1-5-6-7-9(2)8-10(11(12)14)13(3)4/h5-6,9-10H,7-8H2,1-4H3,(H2,12,14)/b6-5+
InChIKeyPKVCYOGXMPXKDH-AATRIKPKSA-N
MW198.31 g/mol
LogP1.39
Rot. Bonds6

About (E)-2-(dimethylamino)-4-methyloct-6-enamide

(E)-2-(dimethylamino)-4-methyloct-6-enamide (PubChem CID 144611499) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (E)-2-(dimethylamino)-4-methyloct-6-enamide.

Molecular Properties

Compound Name(E)-2-(dimethylamino)-4-methyloct-6-enamide
PubChem CID144611499
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(E)-2-(dimethylamino)-4-methyloct-6-enamide
SMILESC/C=C/CC(C)CC(C(N)=O)N(C)C
InChIInChI=1S/C11H22N2O/c1-5-6-7-9(2)8-10(11(12)14)13(3)4/h5-6,9-10H,7-8H2,1-4H3,(H2,12,14)/b6-5+
InChIKeyPKVCYOGXMPXKDH-AATRIKPKSA-N
XLogP1.39
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-2-methylhex-4-enamide
CID 126589197
(E)-2,4-dimethyloct-6-enoic acid
CID 155168823
(3S,5R)-3-(aminomethyl)-5-methylnon-7-enoic acid
CID 57074831
4-methyloct-6-en-2-one
CID 54170853
4-methyl-2-[[4-methyl-3-[methyl(4-methylpentanoyl)amino]pentan-2-ylidene]amino]oct-6-enamide
CID 91438819
(E,3S,4R)-3,4-dimethyloct-6-enamide
CID 89087152
(3R,5R)-3-(dimethylamino)-5-methylnon-7-ene-2,4-dione
CID 173380508
2-(dimethylamino)-3-hydroxy-4-methyloct-6-enoic acid
CID 3371803
(E,2S,3R,4R)-2-(dimethylamino)-3-hydroxy-4-methyloct-6-enoic acid
CID 5289446
(E)-5-methylhept-2-ene
CID 5364849
2-(dimethylamino)-4-methylpent-4-enamide
CID 13149597
2-[2-hydroxypropyl(methyl)amino]butanamide
CID 62901231

Frequently Asked Questions

What is the IUPAC name of (E)-2-(dimethylamino)-4-methyloct-6-enamide?
The IUPAC name of (E)-2-(dimethylamino)-4-methyloct-6-enamide (CID 144611499) is (E)-2-(dimethylamino)-4-methyloct-6-enamide.
What is the SMILES notation for (E)-2-(dimethylamino)-4-methyloct-6-enamide?
The canonical SMILES for (E)-2-(dimethylamino)-4-methyloct-6-enamide is C/C=C/CC(C)CC(C(N)=O)N(C)C.
What is the InChIKey of (E)-2-(dimethylamino)-4-methyloct-6-enamide?
The InChIKey is PKVCYOGXMPXKDH-AATRIKPKSA-N. The full InChI is InChI=1S/C11H22N2O/c1-5-6-7-9(2)8-10(11(12)14)13(3)4/h5-6,9-10H,7-8H2,1-4H3,(H2,12,14)/b6-5+.
What are the key properties of (E)-2-(dimethylamino)-4-methyloct-6-enamide?
(E)-2-(dimethylamino)-4-methyloct-6-enamide has a molecular weight of 198.31 g/mol, XLogP of 1.39, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(dimethylamino)-4-methyloct-6-enamide is sourced from PubChem (CID 144611499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).