5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine

C16H18N4 — CID 81138543

IUPAC5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine
SMILESCc1ccc2nc(N)n(CCCc3ccccc3)c2n1
InChIInChI=1S/C16H18N4/c1-12-9-10-14-15(18-12)20(16(17)19-14)11-5-8-13-6-3-2-4-7-13/h2-4,6-7,9-10H,5,8,11H2,1H3,(H2,17,19)
InChIKeyMYDVMOBJRQPPRD-UHFFFAOYSA-N
MW266.35 g/mol
LogP2.95
Rot. Bonds4

About 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine

5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine (PubChem CID 81138543) has the molecular formula C16H18N4 and a molecular weight of 266.35 g/mol. Its IUPAC name is 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine
PubChem CID81138543
Molecular FormulaC16H18N4
Molecular Weight266.35 g/mol
Exact Mass266.15
IUPAC Name5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine
SMILESCc1ccc2nc(N)n(CCCc3ccccc3)c2n1
InChIInChI=1S/C16H18N4/c1-12-9-10-14-15(18-12)20(16(17)19-14)11-5-8-13-6-3-2-4-7-13/h2-4,6-7,9-10H,5,8,11H2,1H3,(H2,17,19)
InChIKeyMYDVMOBJRQPPRD-UHFFFAOYSA-N
XLogP2.95
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-amino-5-methylimidazo[4,5-b]pyridin-3-yl)pentanamide
CID 106239996
3-(3-ethylsulfanylpropyl)-5-methylimidazo[4,5-b]pyridin-2-amine
CID 114248495
3-[(3-bromophenyl)methyl]-5-methylimidazo[4,5-b]pyridin-2-amine
CID 81138544
5-methyl-3-(1-phenylpropan-2-yl)imidazo[4,5-b]pyridin-2-amine
CID 81135372
3-(2,2-dimethylpropyl)-5-methylimidazo[4,5-b]pyridin-2-amine
CID 81138929
2-methyl-1-(3-phenylpropyl)benzimidazol-5-amine
CID 62506548
1-[4-(4-methylphenyl)butyl]benzimidazol-2-amine
CID 21484264
7-methyl-3-(2-phenylethyl)imidazo[4,5-b]pyridin-2-amine
CID 79288299
3-[(4,5-dimethylthiophen-2-yl)methyl]-5-methylimidazo[4,5-b]pyridin-2-amine
CID 81136141
5-methyl-3-[(3-methyl-1,2-oxazol-5-yl)methyl]imidazo[4,5-b]pyridin-2-amine
CID 81135716
5-methyl-3-(1-phenylethyl)imidazo[4,5-b]pyridin-2-amine
CID 81137999
3-(2,3-dihydro-1-benzofuran-2-ylmethyl)-5-methylimidazo[4,5-b]pyridin-2-amine
CID 81140889

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine (CID 81138543) is 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine is Cc1ccc2nc(N)n(CCCc3ccccc3)c2n1.
What is the InChIKey of 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine?
The InChIKey is MYDVMOBJRQPPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4/c1-12-9-10-14-15(18-12)20(16(17)19-14)11-5-8-13-6-3-2-4-7-13/h2-4,6-7,9-10H,5,8,11H2,1H3,(H2,17,19).
What are the key properties of 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine?
5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine has a molecular weight of 266.35 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-(3-phenylpropyl)imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 81138543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).