(Z)-4-imino-8,8-dimethylnon-5-en-2-amine

C11H22N2 — CID 123296105

IUPAC(Z)-4-imino-8,8-dimethylnon-5-en-2-amine
SMILES[H]/N=C(/C=C\CC(C)(C)C)CC(C)N
InChIInChI=1S/C11H22N2/c1-9(12)8-10(13)6-5-7-11(2,3)4/h5-6,9,13H,7-8,12H2,1-4H3/b6-5-,13-10-
InChIKeyVNCLASKDCUSFGN-MUIHLJEFSA-N
MW182.31 g/mol
LogP2.74
Rot. Bonds4

About (Z)-4-imino-8,8-dimethylnon-5-en-2-amine

(Z)-4-imino-8,8-dimethylnon-5-en-2-amine (PubChem CID 123296105) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is (Z)-4-imino-8,8-dimethylnon-5-en-2-amine.

Molecular Properties

Compound Name(Z)-4-imino-8,8-dimethylnon-5-en-2-amine
PubChem CID123296105
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name(Z)-4-imino-8,8-dimethylnon-5-en-2-amine
SMILES[H]/N=C(/C=C\CC(C)(C)C)CC(C)N
InChIInChI=1S/C11H22N2/c1-9(12)8-10(13)6-5-7-11(2,3)4/h5-6,9,13H,7-8,12H2,1-4H3/b6-5-,13-10-
InChIKeyVNCLASKDCUSFGN-MUIHLJEFSA-N
XLogP2.74
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.74
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)-9-fluoro-4-imino-9,10,10-trimethylundec-5-en-3-amine
CID 123996535
(4E,8E)-2,2-dimethyltrideca-4,8-diene-1,11-diamine
CID 20209203
(4E,8E)-2,2-dimethyldodeca-4,8-diene-1,11-diamine
CID 20209206
2,2-Dimethyltrideca-4,8-diene-1,11-diamine
CID 53836262
2,2-Dimethyldodeca-4,8-diene-1,11-diamine
CID 54042636
6-tert-butyl-2-[(Z)-prop-1-enyl]-2,3-dihydropyridin-3-amine
CID 68352890
(6-Imino-1,4,4-trimethylcycloocta-2,7-dien-1-yl)methanamine
CID 90898811
(Z)-2-methyl-4-methyliminooct-5-en-3-amine
CID 145107660

Frequently Asked Questions

What is the IUPAC name of (Z)-4-imino-8,8-dimethylnon-5-en-2-amine?
The IUPAC name of (Z)-4-imino-8,8-dimethylnon-5-en-2-amine (CID 123296105) is (Z)-4-imino-8,8-dimethylnon-5-en-2-amine.
What is the SMILES notation for (Z)-4-imino-8,8-dimethylnon-5-en-2-amine?
The canonical SMILES for (Z)-4-imino-8,8-dimethylnon-5-en-2-amine is [H]/N=C(/C=C\CC(C)(C)C)CC(C)N.
What is the InChIKey of (Z)-4-imino-8,8-dimethylnon-5-en-2-amine?
The InChIKey is VNCLASKDCUSFGN-MUIHLJEFSA-N. The full InChI is InChI=1S/C11H22N2/c1-9(12)8-10(13)6-5-7-11(2,3)4/h5-6,9,13H,7-8,12H2,1-4H3/b6-5-,13-10-.
What are the key properties of (Z)-4-imino-8,8-dimethylnon-5-en-2-amine?
(Z)-4-imino-8,8-dimethylnon-5-en-2-amine has a molecular weight of 182.31 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-imino-8,8-dimethylnon-5-en-2-amine is sourced from PubChem (CID 123296105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).