(Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine

C10H20N2 — CID 134314093

IUPAC(Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine
SMILESCCC(/N=C/C=C\N)C(C)(C)C
InChIInChI=1S/C10H20N2/c1-5-9(10(2,3)4)12-8-6-7-11/h6-9H,5,11H2,1-4H3/b7-6-,12-8+
InChIKeyIXEDOYDIZMYBKF-UGLNBITBSA-N
MW168.28 g/mol
LogP2.35
Rot. Bonds3

About (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine

(Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine (PubChem CID 134314093) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine
PubChem CID134314093
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine
SMILESCCC(/N=C/C=C\N)C(C)(C)C
InChIInChI=1S/C10H20N2/c1-5-9(10(2,3)4)12-8-6-7-11/h6-9H,5,11H2,1-4H3/b7-6-,12-8+
InChIKeyIXEDOYDIZMYBKF-UGLNBITBSA-N
XLogP2.35
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4,4-dimethyl-1-N-[(Z)-prop-1-enyl]pentane-1,2-diimine
CID 118516099
(Z)-3-(4,4-dimethylhexan-3-ylimino)prop-1-en-1-amine
CID 126672149
(Z)-3-pentan-3-yliminoprop-1-en-1-amine
CID 126672150
(Z)-3-(2,2-dimethylpentan-3-ylimino)but-1-en-1-amine
CID 126672270
(Z)-3-pentan-2-yliminoprop-1-en-1-amine
CID 146659680
propane;(Z)-3-propan-2-yliminoprop-1-en-1-amine
CID 168942466
3-(3-Methylbutan-2-ylimino)prop-1-en-1-amine
CID 173710052
3-[(2R)-3-methylbutan-2-yl]iminoprop-1-en-1-amine
CID 173762318
3-(2-Methylpentan-3-ylimino)prop-1-en-1-amine
CID 174034615
(Z)-3-(2-methylheptan-4-ylimino)prop-1-en-1-amine
CID 177155781
(Z)-3-(5-methylhexan-3-ylimino)prop-1-en-1-amine
CID 178004465

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine?
The IUPAC name of (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine (CID 134314093) is (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine.
What is the SMILES notation for (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine?
The canonical SMILES for (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine is CCC(/N=C/C=C\N)C(C)(C)C.
What is the InChIKey of (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine?
The InChIKey is IXEDOYDIZMYBKF-UGLNBITBSA-N. The full InChI is InChI=1S/C10H20N2/c1-5-9(10(2,3)4)12-8-6-7-11/h6-9H,5,11H2,1-4H3/b7-6-,12-8+.
What are the key properties of (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine?
(Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine has a molecular weight of 168.28 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(2,2-dimethylpentan-3-ylimino)prop-1-en-1-amine is sourced from PubChem (CID 134314093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).