(Z)-5-imino-6-methylhept-3-en-3-amine

C8H16N2 — CID 155718688

IUPAC(Z)-5-imino-6-methylhept-3-en-3-amine
SMILES[H]/N=C(/C=C(\N)CC)C(C)C
InChIInChI=1S/C8H16N2/c1-4-7(9)5-8(10)6(2)3/h5-6,10H,4,9H2,1-3H3/b7-5-,10-8-
InChIKeyCWOYTHZVUOHZNE-RRMOSLQNSA-N
MW140.23 g/mol
LogP1.91
Rot. Bonds3

About (Z)-5-imino-6-methylhept-3-en-3-amine

(Z)-5-imino-6-methylhept-3-en-3-amine (PubChem CID 155718688) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (Z)-5-imino-6-methylhept-3-en-3-amine.

Molecular Properties

Compound Name(Z)-5-imino-6-methylhept-3-en-3-amine
PubChem CID155718688
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(Z)-5-imino-6-methylhept-3-en-3-amine
SMILES[H]/N=C(/C=C(\N)CC)C(C)C
InChIInChI=1S/C8H16N2/c1-4-7(9)5-8(10)6(2)3/h5-6,10H,4,9H2,1-3H3/b7-5-,10-8-
InChIKeyCWOYTHZVUOHZNE-RRMOSLQNSA-N
XLogP1.91
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.91
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

(Z)-5-imino-6,6-dimethyloct-3-en-3-amine
CID 165143010
1-N,3-dimethylbutane-1,2-diimine
CID 123957798
3-methylpentane-1,2-diimine
CID 139890655
(Z)-3-aminopent-2-enoic acid
CID 21472497
4-aminohex-3-en-2-one
CID 57357968
(1E,3Z)-2,4-diaminohexa-1,3-diene-1-thiol
CID 146393049
2-ethylpropanediimidamide;dihydrochloride
CID 87175836
4,5-dimethylhexan-3-imine
CID 123589551
methanamine;propanimidamide
CID 158653796
2-methylpropanimidamide;hydrochloride
CID 2782053
(E)-5-methyliminohex-3-en-3-amine
CID 171096126
1-methylsulfanylbut-1-en-2-amine
CID 163702090

Frequently Asked Questions

What is the IUPAC name of (Z)-5-imino-6-methylhept-3-en-3-amine?
The IUPAC name of (Z)-5-imino-6-methylhept-3-en-3-amine (CID 155718688) is (Z)-5-imino-6-methylhept-3-en-3-amine.
What is the SMILES notation for (Z)-5-imino-6-methylhept-3-en-3-amine?
The canonical SMILES for (Z)-5-imino-6-methylhept-3-en-3-amine is [H]/N=C(/C=C(\N)CC)C(C)C.
What is the InChIKey of (Z)-5-imino-6-methylhept-3-en-3-amine?
The InChIKey is CWOYTHZVUOHZNE-RRMOSLQNSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-7(9)5-8(10)6(2)3/h5-6,10H,4,9H2,1-3H3/b7-5-,10-8-.
What are the key properties of (Z)-5-imino-6-methylhept-3-en-3-amine?
(Z)-5-imino-6-methylhept-3-en-3-amine has a molecular weight of 140.23 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-imino-6-methylhept-3-en-3-amine is sourced from PubChem (CID 155718688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).