(E)-N-ethyl-N,3-dimethylhex-3-en-2-amine

C10H21N — CID 163431483

IUPAC(E)-N-ethyl-N,3-dimethylhex-3-en-2-amine
SMILESCC/C=C(\C)C(C)N(C)CC
InChIInChI=1S/C10H21N/c1-6-8-9(3)10(4)11(5)7-2/h8,10H,6-7H2,1-5H3/b9-8+
InChIKeyAQVQXNRBSPHUDM-CMDGGOBGSA-N
MW155.28 g/mol
LogP2.68
Rot. Bonds4

About (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine

(E)-N-ethyl-N,3-dimethylhex-3-en-2-amine (PubChem CID 163431483) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine.

Molecular Properties

Compound Name(E)-N-ethyl-N,3-dimethylhex-3-en-2-amine
PubChem CID163431483
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(E)-N-ethyl-N,3-dimethylhex-3-en-2-amine
SMILESCC/C=C(\C)C(C)N(C)CC
InChIInChI=1S/C10H21N/c1-6-8-9(3)10(4)11(5)7-2/h8,10H,6-7H2,1-5H3/b9-8+
InChIKeyAQVQXNRBSPHUDM-CMDGGOBGSA-N
XLogP2.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
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

(E,2R)-2,3-dimethylhex-3-enal
CID 88870284
ethane;3-[ethyl(methyl)amino]butan-2-one
CID 177194341
(E,2R)-3-methylhex-3-en-2-amine
CID 146859099
(Z)-4,5-dimethylhept-3-ene
CID 142511472
(Z)-2-propan-2-yloxypent-2-ene
CID 145137792
ethane;2-[ethyl(methyl)amino]propanamide
CID 176567778
N-[(E)-3-methylhex-3-en-2-yl]methanimine
CID 143536776
pent-2-en-2-yl formate
CID 54239805
ethanol;N-ethyl-N-methylbutan-2-amine
CID 88665747
3-[ethyl(methyl)amino]but-1-yn-1-ol
CID 154330111
(E)-N,N-dimethylpent-2-en-2-amine;hydrochloride
CID 155386234
N-methyl-N-[(Z)-[(Z)-3-propan-2-ylhex-3-en-2-ylidene]amino]methanamine
CID 170405604

Frequently Asked Questions

What is the IUPAC name of (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine?
The IUPAC name of (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine (CID 163431483) is (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine.
What is the SMILES notation for (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine?
The canonical SMILES for (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine is CC/C=C(\C)C(C)N(C)CC.
What is the InChIKey of (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine?
The InChIKey is AQVQXNRBSPHUDM-CMDGGOBGSA-N. The full InChI is InChI=1S/C10H21N/c1-6-8-9(3)10(4)11(5)7-2/h8,10H,6-7H2,1-5H3/b9-8+.
What are the key properties of (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine?
(E)-N-ethyl-N,3-dimethylhex-3-en-2-amine has a molecular weight of 155.28 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 (E)-N-ethyl-N,3-dimethylhex-3-en-2-amine is sourced from PubChem (CID 163431483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).