2-methyl-N-propylhex-1-en-3-imine

C10H19N — CID 123390647

IUPAC2-methyl-N-propylhex-1-en-3-imine
SMILESC=C(C)/C(CCC)=N/CCC
InChIInChI=1S/C10H19N/c1-5-7-10(9(3)4)11-8-6-2/h3,5-8H2,1-2,4H3/b11-10+
InChIKeyTZXORRVHCSWWAF-ZHACJKMWSA-N
MW153.27 g/mol
LogP3.21
Rot. Bonds5

About 2-methyl-N-propylhex-1-en-3-imine

2-methyl-N-propylhex-1-en-3-imine (PubChem CID 123390647) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 2-methyl-N-propylhex-1-en-3-imine.

Molecular Properties

Compound Name2-methyl-N-propylhex-1-en-3-imine
PubChem CID123390647
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name2-methyl-N-propylhex-1-en-3-imine
SMILESC=C(C)/C(CCC)=N/CCC
InChIInChI=1S/C10H19N/c1-5-7-10(9(3)4)11-8-6-2/h3,5-8H2,1-2,4H3/b11-10+
InChIKeyTZXORRVHCSWWAF-ZHACJKMWSA-N
XLogP3.21
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-propylpent-3-en-2-imine
CID 123895305
methane;hexakis(2-methylpent-1-ene)
CID 175346690
ethane;N'-propylethanimidamide
CID 156797871
4,5-dimethylideneoctane
CID 13294231
(3E)-3-ethylidene-2-methylhex-1-ene
CID 143524978
heptan-4-imine;2-methylprop-1-ene
CID 175527412
sodium;hydride;2-methylpent-1-ene
CID 174251970
N-ethenyl-N'-propylethanimidamide
CID 123737533
lithium 4-propyliminopent-2-en-2-olate
CID 178130174
2-propyliminopropanoic acid
CID 91004291
3-methyliminohexan-2-one
CID 123425712
2-methylprop-2-enoic acid;pentan-2-one
CID 159816457

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propylhex-1-en-3-imine?
The IUPAC name of 2-methyl-N-propylhex-1-en-3-imine (CID 123390647) is 2-methyl-N-propylhex-1-en-3-imine.
What is the SMILES notation for 2-methyl-N-propylhex-1-en-3-imine?
The canonical SMILES for 2-methyl-N-propylhex-1-en-3-imine is C=C(C)/C(CCC)=N/CCC.
What is the InChIKey of 2-methyl-N-propylhex-1-en-3-imine?
The InChIKey is TZXORRVHCSWWAF-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H19N/c1-5-7-10(9(3)4)11-8-6-2/h3,5-8H2,1-2,4H3/b11-10+.
What are the key properties of 2-methyl-N-propylhex-1-en-3-imine?
2-methyl-N-propylhex-1-en-3-imine has a molecular weight of 153.27 g/mol, XLogP of 3.21, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propylhex-1-en-3-imine is sourced from PubChem (CID 123390647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).