2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine

C14H23N5 — CID 66130350

IUPAC2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine
SMILESCCCn1cncc1-c1nc(C)n(CC(C)C)c1N
InChIInChI=1S/C14H23N5/c1-5-6-18-9-16-7-12(18)13-14(15)19(8-10(2)3)11(4)17-13/h7,9-10H,5-6,8,15H2,1-4H3
InChIKeySTEULYMCNCLZRF-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.70
Rot. Bonds5

About 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine

2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine (PubChem CID 66130350) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine.

Molecular Properties

Compound Name2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine
PubChem CID66130350
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC Name2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine
SMILESCCCn1cncc1-c1nc(C)n(CC(C)C)c1N
InChIInChI=1S/C14H23N5/c1-5-6-18-9-16-7-12(18)13-14(15)19(8-10(2)3)11(4)17-13/h7,9-10H,5-6,8,15H2,1-4H3
InChIKeySTEULYMCNCLZRF-UHFFFAOYSA-N
XLogP2.70
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-3-prop-2-enyl-5-(3-propylimidazol-4-yl)imidazol-4-amine
CID 66130948
3-ethyl-2-methyl-5-(3-propan-2-ylimidazol-4-yl)imidazol-4-amine
CID 66131321
2-propyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
CID 66131753
2-cyclopentyl-3-ethyl-5-(3-propylimidazol-4-yl)imidazol-4-amine
CID 66129956
4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
CID 66131156
2-cyclopropyl-3-prop-2-enyl-5-(3-propylimidazol-4-yl)imidazol-4-amine
CID 66131946
2-cyclopropyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
CID 66131553
2-methyl-3-(2-methylpropyl)-5-(4-propoxyphenyl)imidazol-4-amine
CID 62495772
3-cyclopropyl-2-propyl-5-(3-propylimidazol-4-yl)imidazol-4-amine
CID 66129550
8-bromo-2-(3-propylimidazol-4-yl)imidazo[1,2-a]pyridin-3-amine
CID 66131564
2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
CID 66132148
5-(3-cyclopropylimidazol-4-yl)-2-ethyl-3-(2-methylpropyl)imidazol-4-amine
CID 66164499

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine?
The IUPAC name of 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine (CID 66130350) is 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine.
What is the SMILES notation for 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine?
The canonical SMILES for 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine is CCCn1cncc1-c1nc(C)n(CC(C)C)c1N.
What is the InChIKey of 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine?
The InChIKey is STEULYMCNCLZRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-5-6-18-9-16-7-12(18)13-14(15)19(8-10(2)3)11(4)17-13/h7,9-10H,5-6,8,15H2,1-4H3.
What are the key properties of 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine?
2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine has a molecular weight of 261.37 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2-methylpropyl)-5-(3-propylimidazol-4-yl)imidazol-4-amine is sourced from PubChem (CID 66130350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).