(2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine

C8H14N2 — CID 142082963

IUPAC(2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine
SMILESC=C(C)/C=C(CN)\N=C\C
InChIInChI=1S/C8H14N2/c1-4-10-8(6-9)5-7(2)3/h4-5H,2,6,9H2,1,3H3/b8-5-,10-4+
InChIKeyPXJIHRVAGUFKMD-VRCTZXRLSA-N
MW138.21 g/mol
LogP1.50
Rot. Bonds3

About (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine

(2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine (PubChem CID 142082963) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine.

Molecular Properties

Compound Name(2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine
PubChem CID142082963
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine
SMILESC=C(C)/C=C(CN)\N=C\C
InChIInChI=1S/C8H14N2/c1-4-10-8(6-9)5-7(2)3/h4-5H,2,6,9H2,1,3H3/b8-5-,10-4+
InChIKeyPXJIHRVAGUFKMD-VRCTZXRLSA-N
XLogP1.50
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2E)-2,4-dimethylpenta-2,4-dien-1-amine
CID 126656213
ethane;N-[(4Z)-2-methylhepta-1,4-dien-4-yl]ethanimine
CID 143978503
(Z)-2-(prop-2-enylideneamino)but-2-en-1-amine
CID 142031575
ethane;(1Z)-1-[(Z)-ethylideneamino]-3-methyl-N-propan-2-ylbuta-1,3-dien-1-amine
CID 142520948
N-[(3E)-hexa-1,3-dien-2-yl]ethanimine
CID 148865556
carbanide;bis(2,4-dimethylpenta-1,3-diene);ruthenium(2+)
CID 162297697
N-hept-3-en-4-ylethanimine
CID 123818491
2-amino-N'-prop-1-en-2-ylethanimidamide
CID 126539608
2-methyl-N-prop-1-en-2-ylprop-2-en-1-imine
CID 89323000
(4Z,6Z)-4,6,8-trimethylnona-4,6,8-trien-2-one
CID 142133911
N-[(3E)-3-cyclopropyloxyhexa-1,3-dien-2-yl]ethanimine
CID 166783337
N-methyl-N'-prop-1-en-2-yl-N-sulfanylmethanimidamide
CID 123818085

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine?
The IUPAC name of (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine (CID 142082963) is (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine.
What is the SMILES notation for (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine?
The canonical SMILES for (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine is C=C(C)/C=C(CN)\N=C\C.
What is the InChIKey of (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine?
The InChIKey is PXJIHRVAGUFKMD-VRCTZXRLSA-N. The full InChI is InChI=1S/C8H14N2/c1-4-10-8(6-9)5-7(2)3/h4-5H,2,6,9H2,1,3H3/b8-5-,10-4+.
What are the key properties of (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine?
(2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine has a molecular weight of 138.21 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(ethylideneamino)-4-methylpenta-2,4-dien-1-amine is sourced from PubChem (CID 142082963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).