(Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine

C15H30N2 — CID 126613744

IUPAC(Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine
SMILESCC(C)/N=C(/C=C(\NC(C)C)C(C)C)C(C)C
InChIInChI=1S/C15H30N2/c1-10(2)14(16-12(5)6)9-15(11(3)4)17-13(7)8/h9-13,16H,1-8H3/b14-9-,17-15-
InChIKeyOXOBSWQLEHNKSO-RWJFQYMWSA-N
MW238.42 g/mol
LogP4.03
Rot. Bonds6

About (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine

(Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine (PubChem CID 126613744) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine.

Molecular Properties

Compound Name(Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine
PubChem CID126613744
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name(Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine
SMILESCC(C)/N=C(/C=C(\NC(C)C)C(C)C)C(C)C
InChIInChI=1S/C15H30N2/c1-10(2)14(16-12(5)6)9-15(11(3)4)17-13(7)8/h9-13,16H,1-8H3/b14-9-,17-15-
InChIKeyOXOBSWQLEHNKSO-RWJFQYMWSA-N
XLogP4.03
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 54.03
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)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine?
The IUPAC name of (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine (CID 126613744) is (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine.
What is the SMILES notation for (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine?
The canonical SMILES for (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine is CC(C)/N=C(/C=C(\NC(C)C)C(C)C)C(C)C.
What is the InChIKey of (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine?
The InChIKey is OXOBSWQLEHNKSO-RWJFQYMWSA-N. The full InChI is InChI=1S/C15H30N2/c1-10(2)14(16-12(5)6)9-15(11(3)4)17-13(7)8/h9-13,16H,1-8H3/b14-9-,17-15-.
What are the key properties of (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine?
(Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine has a molecular weight of 238.42 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2,6-dimethyl-N-propan-2-yl-5-propan-2-yliminohept-3-en-3-amine is sourced from PubChem (CID 126613744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).