N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine

C16H31N — CID 123276436

IUPACN-(5-methyl-7-propyldec-1-en-4-yl)ethanimine
SMILESC=CCC(/N=C/C)C(C)CC(CCC)CCC
InChIInChI=1S/C16H31N/c1-6-10-15(11-7-2)13-14(5)16(12-8-3)17-9-4/h8-9,14-16H,3,6-7,10-13H2,1-2,4-5H3/b17-9+
InChIKeyBIQCTMVXOPGBDJ-RQZCQDPDSA-N
MW237.43 g/mol
LogP5.26
Rot. Bonds10

About N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine

N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine (PubChem CID 123276436) has the molecular formula C16H31N and a molecular weight of 237.43 g/mol. Its IUPAC name is N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine.

Molecular Properties

Compound NameN-(5-methyl-7-propyldec-1-en-4-yl)ethanimine
PubChem CID123276436
Molecular FormulaC16H31N
Molecular Weight237.43 g/mol
Exact Mass237.25
IUPAC NameN-(5-methyl-7-propyldec-1-en-4-yl)ethanimine
SMILESC=CCC(/N=C/C)C(C)CC(CCC)CCC
InChIInChI=1S/C16H31N/c1-6-10-15(11-7-2)13-14(5)16(12-8-3)17-9-4/h8-9,14-16H,3,6-7,10-13H2,1-2,4-5H3/b17-9+
InChIKeyBIQCTMVXOPGBDJ-RQZCQDPDSA-N
XLogP5.26
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500237.43
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine 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

3-(ethylideneamino)hexan-2-amine
CID 146742852
2,4-dimethyl-6-propylnonane
CID 57492214
2-propylpent-4-en-1-ol
CID 15525342
(2R)-2-propylpent-4-en-1-ol
CID 102443891
ethane;5-methyloct-1-en-4-ol
CID 142059047
4,6,7,10-tetramethyltridec-1-ene
CID 123527597
6,6-dimethyl-4-propylhept-1-ene
CID 123561770
5-butyl-7,8-dimethylnon-1-ene
CID 123319665
but-1-ene;4-methylpent-1-ene;prop-1-ene
CID 172806960
3-ethylhexane;2-methylhexane;prop-1-ene
CID 144809780
but-1-ene;4-methylpent-1-ene
CID 23001909
N-pent-4-en-2-ylhexan-3-amine
CID 103921873

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine?
The IUPAC name of N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine (CID 123276436) is N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine.
What is the SMILES notation for N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine?
The canonical SMILES for N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine is C=CCC(/N=C/C)C(C)CC(CCC)CCC.
What is the InChIKey of N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine?
The InChIKey is BIQCTMVXOPGBDJ-RQZCQDPDSA-N. The full InChI is InChI=1S/C16H31N/c1-6-10-15(11-7-2)13-14(5)16(12-8-3)17-9-4/h8-9,14-16H,3,6-7,10-13H2,1-2,4-5H3/b17-9+.
What are the key properties of N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine?
N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine has a molecular weight of 237.43 g/mol, XLogP of 5.26, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-7-propyldec-1-en-4-yl)ethanimine is sourced from PubChem (CID 123276436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).