(E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine

C9H18N2 — CID 87570070

IUPAC(E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine
SMILESC/N=C(C)/C=C(\C)NC(C)C
InChIInChI=1S/C9H18N2/c1-7(2)11-9(4)6-8(3)10-5/h6-7,11H,1-5H3/b9-6+,10-8+
InChIKeyBSSSVFVJNWUXQU-OAMUUVBCSA-N
MW154.26 g/mol
LogP1.98
Rot. Bonds3

About (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine

(E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine (PubChem CID 87570070) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine.

Molecular Properties

Compound Name(E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine
PubChem CID87570070
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine
SMILESC/N=C(C)/C=C(\C)NC(C)C
InChIInChI=1S/C9H18N2/c1-7(2)11-9(4)6-8(3)10-5/h6-7,11H,1-5H3/b9-6+,10-8+
InChIKeyBSSSVFVJNWUXQU-OAMUUVBCSA-N
XLogP1.98
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5,7-Dimethyl-2,3-dihydro-1H-[1,4]diazepine
CID 81731
(4E)-N-(Propan-2-yl)-4-[(propan-2-yl)imino]pent-2-en-2-amine
CID 71353734
(E)-N-isopropyl-7-(isopropylimino)cyclohepta-1,3,5-trienamine
CID 777099
2,4,9,11-Tetramethyl-1,5,8,12-tetraazacyclotetradeca-1,3,9,11-tetraene
CID 10890274
2-(Methylamino)-4-(methylimino)-pentene-2
CID 14983634
(Z)-N-ethyl-4-ethyliminopent-2-en-2-amine
CID 22857106
(Z)-N-(2-methylpropyl)-4-(2-methylpropylimino)pent-2-en-2-amine
CID 49804015
N-Methyl-4-(methylimino)-2-penten-2-amine
CID 72320248
(Z)-N-propan-2-yl-4-propan-2-yliminopent-2-en-2-amine
CID 102023638
(Z)-N-propyl-4-propyliminopent-2-en-2-amine
CID 102026407
(Z)-N-tert-butyl-4-tert-butyliminopent-2-en-2-amine
CID 126613755
(Z)-1,7-difluoro-N-propyl-5-propyliminohept-3-en-3-amine
CID 156290789

Frequently Asked Questions

What is the IUPAC name of (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine?
The IUPAC name of (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine (CID 87570070) is (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine.
What is the SMILES notation for (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine?
The canonical SMILES for (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine is C/N=C(C)/C=C(\C)NC(C)C.
What is the InChIKey of (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine?
The InChIKey is BSSSVFVJNWUXQU-OAMUUVBCSA-N. The full InChI is InChI=1S/C9H18N2/c1-7(2)11-9(4)6-8(3)10-5/h6-7,11H,1-5H3/b9-6+,10-8+.
What are the key properties of (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine?
(E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine has a molecular weight of 154.26 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-methylimino-N-propan-2-ylpent-2-en-2-amine is sourced from PubChem (CID 87570070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).