(2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine

C10H19N — CID 13023821

IUPAC(2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine
SMILESC=C(C)/C=C/CN(CC)CC
InChIInChI=1S/C10H19N/c1-5-11(6-2)9-7-8-10(3)4/h7-8H,3,5-6,9H2,1-2,4H3/b8-7+
InChIKeyBHHZIZGFKQRXEL-BQYQJAHWSA-N
MW153.27 g/mol
LogP2.46
Rot. Bonds5

About (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine

(2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine (PubChem CID 13023821) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine.

Molecular Properties

Compound Name(2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine
PubChem CID13023821
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine
SMILESC=C(C)/C=C/CN(CC)CC
InChIInChI=1S/C10H19N/c1-5-11(6-2)9-7-8-10(3)4/h7-8H,3,5-6,9H2,1-2,4H3/b8-7+
InChIKeyBHHZIZGFKQRXEL-BQYQJAHWSA-N
XLogP2.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

1-Methyl-4-vinyl-1,2,3,6-tetrahydro-pyridine
CID 10036134
2,6-Octadien-1-amine, N,N-diethyl-3,7-dimethyl-, (2E)-
CID 6390621
2,6,10-Dodecatrienylamine, N-allyl-N,3,7,11-tetramethyl
CID 6434915
n,n-Diethyl-3.7-dimethyl-2.6-octadiene-1-amine
CID 324495
(Z)-N,N-Diethyl-3,7-dimethylocta-2,6-dien-1-amine
CID 6243343
N,N-Diethyl-2-methylidenebut-3-en-1-amine
CID 14644961
o-Lithiodimethylbenzylamine
CID 10866427
2,6-Bis(dimethylaminomethyl)phenyllithium
CID 11830389
5-ethyl-1-methyl-2H-pyridine
CID 12506167
2-Methylidene-N,N-dipropylbut-3-en-1-amine
CID 18512648
2-Diethylaminomethylphenyllithium
CID 21399648
2-[(Diethylamino)methyl]phenylmagnesium bromide, 0.25M in THF
CID 57533218

Frequently Asked Questions

What is the IUPAC name of (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine?
The IUPAC name of (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine (CID 13023821) is (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine.
What is the SMILES notation for (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine?
The canonical SMILES for (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine is C=C(C)/C=C/CN(CC)CC.
What is the InChIKey of (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine?
The InChIKey is BHHZIZGFKQRXEL-BQYQJAHWSA-N. The full InChI is InChI=1S/C10H19N/c1-5-11(6-2)9-7-8-10(3)4/h7-8H,3,5-6,9H2,1-2,4H3/b8-7+.
What are the key properties of (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine?
(2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.46, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N,N-diethyl-4-methylpenta-2,4-dien-1-amine is sourced from PubChem (CID 13023821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).