(Z)-3-(2-methylpropylimino)but-1-en-1-amine

C8H16N2 — CID 166001507

IUPAC(Z)-3-(2-methylpropylimino)but-1-en-1-amine
SMILESCC(/C=C\N)=N\CC(C)C
InChIInChI=1S/C8H16N2/c1-7(2)6-10-8(3)4-5-9/h4-5,7H,6,9H2,1-3H3/b5-4-,10-8+
InChIKeyLZXZVCNMRJNPFK-BTCMVDHLSA-N
MW140.23 g/mol
LogP1.58
Rot. Bonds3

About (Z)-3-(2-methylpropylimino)but-1-en-1-amine

(Z)-3-(2-methylpropylimino)but-1-en-1-amine (PubChem CID 166001507) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (Z)-3-(2-methylpropylimino)but-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-(2-methylpropylimino)but-1-en-1-amine
PubChem CID166001507
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(Z)-3-(2-methylpropylimino)but-1-en-1-amine
SMILESCC(/C=C\N)=N\CC(C)C
InChIInChI=1S/C8H16N2/c1-7(2)6-10-8(3)4-5-9/h4-5,7H,6,9H2,1-3H3/b5-4-,10-8+
InChIKeyLZXZVCNMRJNPFK-BTCMVDHLSA-N
XLogP1.58
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[[(Z)-4-aminobut-3-en-2-ylidene]amino]acetonitrile
CID 59932316
(Z)-3-ethenyliminobut-1-en-1-amine
CID 87419799
(Z)-2-(but-3-en-2-ylideneamino)ethenamine
CID 88558951
(Z)-3-ethenylimino-4-methylpent-1-en-1-amine
CID 88880427
(Z)-2-(pent-1-en-3-ylideneamino)ethenamine
CID 88936606
(Z)-3-prop-1-en-2-yliminobut-1-en-1-amine
CID 88985932
3-[(Z)-2-aminoethenyl]iminobut-1-en-2-amine
CID 89054135
(Z)-3-methyl-2-(4-methylpent-1-en-3-ylideneamino)but-1-en-1-amine
CID 89109237
2-Ethenyliminobut-3-en-1-amine
CID 89187037
(Z)-2-(4-methylpent-1-en-3-ylideneamino)ethenamine
CID 89297845
(Z)-3-ethyliminobut-1-en-1-amine
CID 89360099
(Z)-3-(3-methylbut-1-en-2-ylimino)prop-1-en-1-amine
CID 89410300

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(2-methylpropylimino)but-1-en-1-amine?
The IUPAC name of (Z)-3-(2-methylpropylimino)but-1-en-1-amine (CID 166001507) is (Z)-3-(2-methylpropylimino)but-1-en-1-amine.
What is the SMILES notation for (Z)-3-(2-methylpropylimino)but-1-en-1-amine?
The canonical SMILES for (Z)-3-(2-methylpropylimino)but-1-en-1-amine is CC(/C=C\N)=N\CC(C)C.
What is the InChIKey of (Z)-3-(2-methylpropylimino)but-1-en-1-amine?
The InChIKey is LZXZVCNMRJNPFK-BTCMVDHLSA-N. The full InChI is InChI=1S/C8H16N2/c1-7(2)6-10-8(3)4-5-9/h4-5,7H,6,9H2,1-3H3/b5-4-,10-8+.
What are the key properties of (Z)-3-(2-methylpropylimino)but-1-en-1-amine?
(Z)-3-(2-methylpropylimino)but-1-en-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(2-methylpropylimino)but-1-en-1-amine is sourced from PubChem (CID 166001507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).