(Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine

C14H26N2 — CID 134345725

IUPAC(Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine
SMILESC/C=C\C(CC)/C(C)=N/C=C(\N)CC(C)C
InChIInChI=1S/C14H26N2/c1-6-8-13(7-2)12(5)16-10-14(15)9-11(3)4/h6,8,10-11,13H,7,9,15H2,1-5H3/b8-6-,14-10-,16-12+
InChIKeyKZYVAFZDASXUKW-PAQAAFCHSA-N
MW222.38 g/mol
LogP3.90
Rot. Bonds6

About (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine

(Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine (PubChem CID 134345725) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine.

Molecular Properties

Compound Name(Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine
PubChem CID134345725
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name(Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine
SMILESC/C=C\C(CC)/C(C)=N/C=C(\N)CC(C)C
InChIInChI=1S/C14H26N2/c1-6-8-13(7-2)12(5)16-10-14(15)9-11(3)4/h6,8,10-11,13H,7,9,15H2,1-5H3/b8-6-,14-10-,16-12+
InChIKeyKZYVAFZDASXUKW-PAQAAFCHSA-N
XLogP3.90
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine?
The IUPAC name of (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine (CID 134345725) is (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine.
What is the SMILES notation for (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine?
The canonical SMILES for (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine is C/C=C\C(CC)/C(C)=N/C=C(\N)CC(C)C.
What is the InChIKey of (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine?
The InChIKey is KZYVAFZDASXUKW-PAQAAFCHSA-N. The full InChI is InChI=1S/C14H26N2/c1-6-8-13(7-2)12(5)16-10-14(15)9-11(3)4/h6,8,10-11,13H,7,9,15H2,1-5H3/b8-6-,14-10-,16-12+.
What are the key properties of (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine?
(Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine has a molecular weight of 222.38 g/mol, XLogP of 3.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[[(Z)-3-ethylhex-4-en-2-ylidene]amino]-4-methylpent-1-en-2-amine is sourced from PubChem (CID 134345725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).