(Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine

C13H25N — CID 146568641

IUPAC(Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine
SMILESC/C=C\C(=C/C)CN(CC)CC(C)C
InChIInChI=1S/C13H25N/c1-6-9-13(7-2)11-14(8-3)10-12(4)5/h6-7,9,12H,8,10-11H2,1-5H3/b9-6-,13-7+
InChIKeyRSHHQUOLVZQNPL-XGLIJBRHSA-N
MW195.35 g/mol
LogP3.49
Rot. Bonds6

About (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine

(Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine (PubChem CID 146568641) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine.

Molecular Properties

Compound Name(Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine
PubChem CID146568641
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name(Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine
SMILESC/C=C\C(=C/C)CN(CC)CC(C)C
InChIInChI=1S/C13H25N/c1-6-9-13(7-2)11-14(8-3)10-12(4)5/h6-7,9,12H,8,10-11H2,1-5H3/b9-6-,13-7+
InChIKeyRSHHQUOLVZQNPL-XGLIJBRHSA-N
XLogP3.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z,2E)-N-ethyl-N-(2-ethylbutyl)-2-ethylidenepent-3-en-1-amine
CID 178156777
(Z,2E)-2-ethylidene-N-methyl-N-(2-methylpropyl)pent-3-en-1-amine
CID 145367899
2-[ethyl(2-methylpropyl)amino]acetic acid
CID 43273893
(Z,4Z)-4-ethylidene-7-methyloct-2-ene
CID 142183675
(Z,2E)-2-ethylidene-N,N-dimethylpent-3-en-1-amine
CID 156713234
2-[ethyl(2-methylpropyl)amino]acetohydrazide
CID 63574008
ethane;ethene;(2Z,4Z)-3-ethylhexa-2,4-diene
CID 144709527
ethane;2-[ethyl-[(2E)-2-[(Z)-prop-1-enyl]penta-2,4-dienyl]amino]acetic acid
CID 143432503
N'-ethyl-N'-[(2E,3Z)-2-ethylidenehepta-3,6-dienyl]-N,N-dimethylethane-1,2-diamine
CID 130183526
(3Z)-N,N-bis(2-methylpropyl)penta-1,3-dien-2-amine
CID 130331308
(2E,3Z)-N-ethyl-2-ethylidene-N-propylhexa-3,5-dien-1-amine;propane
CID 144845989
1-cyclohexyl-2-[ethyl(2-methylpropyl)amino]ethanone
CID 104750015

Frequently Asked Questions

What is the IUPAC name of (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine?
The IUPAC name of (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine (CID 146568641) is (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine.
What is the SMILES notation for (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine?
The canonical SMILES for (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine is C/C=C\C(=C/C)CN(CC)CC(C)C.
What is the InChIKey of (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine?
The InChIKey is RSHHQUOLVZQNPL-XGLIJBRHSA-N. The full InChI is InChI=1S/C13H25N/c1-6-9-13(7-2)11-14(8-3)10-12(4)5/h6-7,9,12H,8,10-11H2,1-5H3/b9-6-,13-7+.
What are the key properties of (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine?
(Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.49, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2E)-N-ethyl-2-ethylidene-N-(2-methylpropyl)pent-3-en-1-amine is sourced from PubChem (CID 146568641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).