2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine

C19H24N4O — CID 3212346

IUPAC2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine
SMILESCCCCc1nc2cc(N)c(C)nc2n1Cc1ccc(OC)cc1
InChIInChI=1S/C19H24N4O/c1-4-5-6-18-22-17-11-16(20)13(2)21-19(17)23(18)12-14-7-9-15(24-3)10-8-14/h7-11H,4-6,12,20H2,1-3H3
InChIKeyDWROLAXKXAZADF-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.72
Rot. Bonds6

About 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine

2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine (PubChem CID 3212346) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine.

Molecular Properties

Compound Name2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine
PubChem CID3212346
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine
SMILESCCCCc1nc2cc(N)c(C)nc2n1Cc1ccc(OC)cc1
InChIInChI=1S/C19H24N4O/c1-4-5-6-18-22-17-11-16(20)13(2)21-19(17)23(18)12-14-7-9-15(24-3)10-8-14/h7-11H,4-6,12,20H2,1-3H3
InChIKeyDWROLAXKXAZADF-UHFFFAOYSA-N
XLogP3.72
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-butyl-5-methyl-3-[(3-nitrophenyl)methyl]imidazo[4,5-b]pyridin-6-amine
CID 3212391
1-[2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-yl]-3-ethylurea
CID 3212345
1-[2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-yl]-3-(3-chlorophenyl)urea
CID 3212343
[4-[(2-butyl-6-methylimidazo[4,5-b]pyridin-3-yl)methyl]phenyl]methanamine
CID 94758182
4-[(2-butyl-6-chloroimidazo[4,5-b]pyridin-3-yl)methyl]aniline
CID 94758162
2-butyl-1-[(4-methoxyphenyl)methyl]-7-prop-1-en-2-ylimidazo[4,5-d]pyridazin-4-amine
CID 164855663
tert-butyl N-[3-[(4-bromophenyl)methyl]-2-butyl-5-methylimidazo[4,5-b]pyridin-6-yl]carbamate
CID 3205871
4-amino-1-[(4-methoxyphenyl)methyl]-5-pentylpyrrole-2-carbonitrile
CID 100768502
N-[2-butyl-3-[(4-chlorophenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-yl]benzamide
CID 3197681
4-[(2-butylbenzimidazol-1-yl)methyl]aniline
CID 54524981
1-(3-benzyl-2-butyl-5-methylimidazo[4,5-b]pyridin-6-yl)-3-phenylurea
CID 3205884
N-(3-benzyl-2-butyl-5-methylimidazo[4,5-b]pyridin-6-yl)-2,2-dimethylpropanamide
CID 3205877

Frequently Asked Questions

What is the IUPAC name of 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine?
The IUPAC name of 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine (CID 3212346) is 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine.
What is the SMILES notation for 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine?
The canonical SMILES for 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine is CCCCc1nc2cc(N)c(C)nc2n1Cc1ccc(OC)cc1.
What is the InChIKey of 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine?
The InChIKey is DWROLAXKXAZADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O/c1-4-5-6-18-22-17-11-16(20)13(2)21-19(17)23(18)12-14-7-9-15(24-3)10-8-14/h7-11H,4-6,12,20H2,1-3H3.
What are the key properties of 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine?
2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine has a molecular weight of 324.43 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-3-[(4-methoxyphenyl)methyl]-5-methylimidazo[4,5-b]pyridin-6-amine is sourced from PubChem (CID 3212346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).