(Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine

C12H24N2 — CID 144695951

IUPAC(Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine
SMILESCCC(C)(CC)/C(N)=C/N=C/C(C)C
InChIInChI=1S/C12H24N2/c1-6-12(5,7-2)11(13)9-14-8-10(3)4/h8-10H,6-7,13H2,1-5H3/b11-9-,14-8+
InChIKeyGEPNHAMWFZOJAT-WBCUMWNESA-N
MW196.34 g/mol
LogP3.34
Rot. Bonds5

About (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine

(Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine (PubChem CID 144695951) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine.

Molecular Properties

Compound Name(Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine
PubChem CID144695951
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name(Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine
SMILESCCC(C)(CC)/C(N)=C/N=C/C(C)C
InChIInChI=1S/C12H24N2/c1-6-12(5,7-2)11(13)9-14-8-10(3)4/h8-10H,6-7,13H2,1-5H3/b11-9-,14-8+
InChIKeyGEPNHAMWFZOJAT-WBCUMWNESA-N
XLogP3.34
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine?
The IUPAC name of (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine (CID 144695951) is (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine.
What is the SMILES notation for (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine?
The canonical SMILES for (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine is CCC(C)(CC)/C(N)=C/N=C/C(C)C.
What is the InChIKey of (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine?
The InChIKey is GEPNHAMWFZOJAT-WBCUMWNESA-N. The full InChI is InChI=1S/C12H24N2/c1-6-12(5,7-2)11(13)9-14-8-10(3)4/h8-10H,6-7,13H2,1-5H3/b11-9-,14-8+.
What are the key properties of (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine?
(Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine has a molecular weight of 196.34 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-ethyl-3-methyl-1-(2-methylpropylideneamino)pent-1-en-2-amine is sourced from PubChem (CID 144695951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).