2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole

C9H18N2 — CID 141398715

IUPAC2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole
SMILESCCCN1C(C)=NC(C)C1C
InChIInChI=1S/C9H18N2/c1-5-6-11-8(3)7(2)10-9(11)4/h7-8H,5-6H2,1-4H3
InChIKeyNTBNMHCSPMQTIQ-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.91
Rot. Bonds2

About 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole

2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole (PubChem CID 141398715) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole.

Molecular Properties

Compound Name2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole
PubChem CID141398715
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole
SMILESCCCN1C(C)=NC(C)C1C
InChIInChI=1S/C9H18N2/c1-5-6-11-8(3)7(2)10-9(11)4/h7-8H,5-6H2,1-4H3
InChIKeyNTBNMHCSPMQTIQ-UHFFFAOYSA-N
XLogP1.91
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4,5-trimethyl-2-(2-methylbutan-2-yl)-4,5-dihydroimidazole
CID 20689610
2,3-dimethyl-1-propyl-2,3-dihydroindole
CID 161026697
4,6-dimethyl-1,3-dipropyl-1,4-dihydropyrimidin-1-ium-2-thione chloride
CID 87882205
3,6-dimethyl-1-propyl-1-azacyclohept-4-yne
CID 143070430
5-methyl-6-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83241893
4-(hydroxymethyl)-5-methyl-1-propylpyrrolidin-2-one
CID 117021849
3-cyclopropyl-4,5-dipropyl-1,2,4-triazole
CID 144754875
(3S,4S)-3,4-dimethyl-1-propylpyrrolidine
CID 59055005
(2R)-2-hydroxy-3,4-dimethyl-1-propyl-2H-pyrrol-5-one
CID 7357026
(2S)-2-hydroxy-3,4-dimethyl-1-propyl-2H-pyrrol-5-one
CID 7357027
ethene;(5R)-5-methyl-1-propylpyrrolidin-2-one
CID 145214159
3-chloro-5-methyl-4-propyl-1,2,4-triazole
CID 63384341

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole?
The IUPAC name of 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole (CID 141398715) is 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole.
What is the SMILES notation for 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole?
The canonical SMILES for 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole is CCCN1C(C)=NC(C)C1C.
What is the InChIKey of 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole?
The InChIKey is NTBNMHCSPMQTIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-5-6-11-8(3)7(2)10-9(11)4/h7-8H,5-6H2,1-4H3.
What are the key properties of 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole?
2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole has a molecular weight of 154.26 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-1-propyl-4,5-dihydroimidazole is sourced from PubChem (CID 141398715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).