(E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine

C14H25N3 — CID 143327507

IUPAC(E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine
SMILESCC/C=N/C(=C(C)C)/C(C)=N\C(N)=C\CCC
InChIInChI=1S/C14H25N3/c1-6-8-9-13(15)17-12(5)14(11(3)4)16-10-7-2/h9-10H,6-8,15H2,1-5H3/b13-9+,16-10+,17-12-
InChIKeyUTDKDRWNNCIJIN-HPPRDLQCSA-N
MW235.37 g/mol
LogP3.82
Rot. Bonds6

About (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine

(E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine (PubChem CID 143327507) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine.

Molecular Properties

Compound Name(E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine
PubChem CID143327507
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name(E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine
SMILESCC/C=N/C(=C(C)C)/C(C)=N\C(N)=C\CCC
InChIInChI=1S/C14H25N3/c1-6-8-9-13(15)17-12(5)14(11(3)4)16-10-7-2/h9-10H,6-8,15H2,1-5H3/b13-9+,16-10+,17-12-
InChIKeyUTDKDRWNNCIJIN-HPPRDLQCSA-N
XLogP3.82
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine with MolForge

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Related Compounds

(3Z)-3-[1-(ethylideneamino)ethylidene]pyridin-4-imine
CID 89712822
1-(3,4-Dihydropyridin-6-yl)ethanimine
CID 90783991
(Z)-2-ethyl-N-[(E)-hex-2-en-2-yl]but-2-en-1-imine
CID 122651509
2-[(2Z,6Z)-7-ethyl-4,5-dihydroazocin-2-yl]ethanimine
CID 123178485
(E)-3-N-butan-2-ylidene-1-N-ethylpent-2-ene-1,3-diimine
CID 123210191
(Z)-1-N-ethyl-2-N-methyl-6-methylidenehept-3-ene-1,2,7-triimine
CID 123329124
(E)-2-[[(Z)-2-ethylbut-2-enylidene]amino]but-1-en-1-amine
CID 123331055
(Z)-3-N-[(Z)-2-methylbut-2-enylidene]hex-2-ene-1,3-diimine
CID 123358061
1-(3,4-Dihydropyridin-6-yl)propan-1-imine
CID 123412427
(2Z)-2-ethylidene-3-N-methylhexane-1,3-diimine
CID 123422802
(E)-3-methyl-2-N-(3-methylbut-3-en-2-ylidene)pent-2-ene-1,2-diimine
CID 123601744
(2Z)-2-ethylidene-3-N-methylpentane-1,3-diimine
CID 123743575

Frequently Asked Questions

What is the IUPAC name of (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine?
The IUPAC name of (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine (CID 143327507) is (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine.
What is the SMILES notation for (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine?
The canonical SMILES for (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine is CC/C=N/C(=C(C)C)/C(C)=N\C(N)=C\CCC.
What is the InChIKey of (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine?
The InChIKey is UTDKDRWNNCIJIN-HPPRDLQCSA-N. The full InChI is InChI=1S/C14H25N3/c1-6-8-9-13(15)17-12(5)14(11(3)4)16-10-7-2/h9-10H,6-8,15H2,1-5H3/b13-9+,16-10+,17-12-.
What are the key properties of (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine?
(E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine has a molecular weight of 235.37 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-[(Z)-[4-methyl-3-(propylideneamino)pent-3-en-2-ylidene]amino]pent-1-en-1-amine is sourced from PubChem (CID 143327507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).