(Z)-3-ethyl-4-iminohex-2-en-2-amine

C8H16N2 — CID 142555110

IUPAC(Z)-3-ethyl-4-iminohex-2-en-2-amine
SMILES[H]/N=C(CC)/C(CC)=C(/C)N
InChIInChI=1S/C8H16N2/c1-4-7(6(3)9)8(10)5-2/h10H,4-5,9H2,1-3H3/b7-6-,10-8+
InChIKeyCCLLPEQONAQPQI-VAAURPRASA-N
MW140.23 g/mol
LogP2.06
Rot. Bonds3

About (Z)-3-ethyl-4-iminohex-2-en-2-amine

(Z)-3-ethyl-4-iminohex-2-en-2-amine (PubChem CID 142555110) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (Z)-3-ethyl-4-iminohex-2-en-2-amine.

Molecular Properties

Compound Name(Z)-3-ethyl-4-iminohex-2-en-2-amine
PubChem CID142555110
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(Z)-3-ethyl-4-iminohex-2-en-2-amine
SMILES[H]/N=C(CC)/C(CC)=C(/C)N
InChIInChI=1S/C8H16N2/c1-4-7(6(3)9)8(10)5-2/h10H,4-5,9H2,1-3H3/b7-6-,10-8+
InChIKeyCCLLPEQONAQPQI-VAAURPRASA-N
XLogP2.06
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 ≤ 52.06
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

(1Z)-1-(2-iminocyclohexylidene)ethanamine
CID 88892355
(Z)-4-imino-3-methylpent-2-en-2-amine
CID 89138473
(Z)-3-methanimidoylhept-2-en-2-amine
CID 89142772
(Z)-5-imino-2,6-dimethyl-4-propan-2-ylhept-3-en-3-amine
CID 90075918
3,4-Dimethyloct-3-en-2-imine
CID 91072612
(Z)-4-imino-3,5-dimethylhex-2-en-2-amine
CID 118348642
2,3-Dimethylnon-2-en-4-imine
CID 123464515
2-Cyclobutylidenehexan-3-imine
CID 123511934
(1Z)-1-(2-iminocycloheptylidene)ethanamine
CID 126606135
(Z)-4-ethyl-5-methyloct-4-en-2-imine
CID 126639810
(1Z)-1-(2-iminocyclopentylidene)ethanamine
CID 129091603
(Z)-3-ethanimidoylhept-2-en-2-amine
CID 129144914

Frequently Asked Questions

What is the IUPAC name of (Z)-3-ethyl-4-iminohex-2-en-2-amine?
The IUPAC name of (Z)-3-ethyl-4-iminohex-2-en-2-amine (CID 142555110) is (Z)-3-ethyl-4-iminohex-2-en-2-amine.
What is the SMILES notation for (Z)-3-ethyl-4-iminohex-2-en-2-amine?
The canonical SMILES for (Z)-3-ethyl-4-iminohex-2-en-2-amine is [H]/N=C(CC)/C(CC)=C(/C)N.
What is the InChIKey of (Z)-3-ethyl-4-iminohex-2-en-2-amine?
The InChIKey is CCLLPEQONAQPQI-VAAURPRASA-N. The full InChI is InChI=1S/C8H16N2/c1-4-7(6(3)9)8(10)5-2/h10H,4-5,9H2,1-3H3/b7-6-,10-8+.
What are the key properties of (Z)-3-ethyl-4-iminohex-2-en-2-amine?
(Z)-3-ethyl-4-iminohex-2-en-2-amine has a molecular weight of 140.23 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-ethyl-4-iminohex-2-en-2-amine is sourced from PubChem (CID 142555110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).