(Z)-5-imino-2-methylhex-3-en-1-amine

C7H14N2 — CID 123452418

IUPAC(Z)-5-imino-2-methylhex-3-en-1-amine
SMILES[H]/N=C(C)/C=C\C(C)CN
InChIInChI=1S/C7H14N2/c1-6(5-8)3-4-7(2)9/h3-4,6,9H,5,8H2,1-2H3/b4-3-,9-7+
InChIKeyAKXILAFLLLJAII-GAWLIRPZSA-N
MW126.20 g/mol
LogP1.18
Rot. Bonds3

About (Z)-5-imino-2-methylhex-3-en-1-amine

(Z)-5-imino-2-methylhex-3-en-1-amine (PubChem CID 123452418) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is (Z)-5-imino-2-methylhex-3-en-1-amine.

Molecular Properties

Compound Name(Z)-5-imino-2-methylhex-3-en-1-amine
PubChem CID123452418
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name(Z)-5-imino-2-methylhex-3-en-1-amine
SMILES[H]/N=C(C)/C=C\C(C)CN
InChIInChI=1S/C7H14N2/c1-6(5-8)3-4-7(2)9/h3-4,6,9H,5,8H2,1-2H3/b4-3-,9-7+
InChIKeyAKXILAFLLLJAII-GAWLIRPZSA-N
XLogP1.18
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Iminocyclohexa-2,5-dien-1-amine
CID 140108
(Z)-pent-2-ene-1,4-diimine
CID 59089718
(Z)-2-iminopent-3-ene-1,4-diamine
CID 89129435
5-Methylhex-3-en-2-imine
CID 90806182
2-[[(Z)-pent-3-en-2-ylidene]amino]ethanamine
CID 91302499
(Z)-2-iminohept-3-en-1-amine
CID 91316058
(Z)-6-iminohept-4-en-1-amine
CID 91431506
(Z)-5-methylhex-3-en-2-imine
CID 118335229
(E)-4-imino-2-methylpent-2-en-1-amine
CID 118534600
(Z)-2-methyliminohex-3-en-1-amine
CID 123256608
(Z)-2-iminopent-3-en-1-amine
CID 123316218
1-(Pent-3-en-2-ylideneamino)ethanamine
CID 123330038

Frequently Asked Questions

What is the IUPAC name of (Z)-5-imino-2-methylhex-3-en-1-amine?
The IUPAC name of (Z)-5-imino-2-methylhex-3-en-1-amine (CID 123452418) is (Z)-5-imino-2-methylhex-3-en-1-amine.
What is the SMILES notation for (Z)-5-imino-2-methylhex-3-en-1-amine?
The canonical SMILES for (Z)-5-imino-2-methylhex-3-en-1-amine is [H]/N=C(C)/C=C\C(C)CN.
What is the InChIKey of (Z)-5-imino-2-methylhex-3-en-1-amine?
The InChIKey is AKXILAFLLLJAII-GAWLIRPZSA-N. The full InChI is InChI=1S/C7H14N2/c1-6(5-8)3-4-7(2)9/h3-4,6,9H,5,8H2,1-2H3/b4-3-,9-7+.
What are the key properties of (Z)-5-imino-2-methylhex-3-en-1-amine?
(Z)-5-imino-2-methylhex-3-en-1-amine has a molecular weight of 126.20 g/mol, XLogP of 1.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-imino-2-methylhex-3-en-1-amine is sourced from PubChem (CID 123452418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).