N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine

C15H16N4 — CID 79821248

IUPACN-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCNc1ccc2[nH]c(CCc3ccccc3)nc2n1
InChIInChI=1S/C15H16N4/c1-16-13-10-8-12-15(18-13)19-14(17-12)9-7-11-5-3-2-4-6-11/h2-6,8,10H,7,9H2,1H3,(H2,16,17,18,19)
InChIKeyDWWCSVLMZMDODR-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.78
Rot. Bonds4

About N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine

N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine (PubChem CID 79821248) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound NameN-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine
PubChem CID79821248
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC NameN-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine
SMILESCNc1ccc2[nH]c(CCc3ccccc3)nc2n1
InChIInChI=1S/C15H16N4/c1-16-13-10-8-12-15(18-13)19-14(17-12)9-7-11-5-3-2-4-6-11/h2-6,8,10H,7,9H2,1H3,(H2,16,17,18,19)
InChIKeyDWWCSVLMZMDODR-UHFFFAOYSA-N
XLogP2.78
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The IUPAC name of N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine (CID 79821248) is N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine.
What is the SMILES notation for N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The canonical SMILES for N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine is CNc1ccc2[nH]c(CCc3ccccc3)nc2n1.
What is the InChIKey of N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine?
The InChIKey is DWWCSVLMZMDODR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-16-13-10-8-12-15(18-13)19-14(17-12)9-7-11-5-3-2-4-6-11/h2-6,8,10H,7,9H2,1H3,(H2,16,17,18,19).
What are the key properties of N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine?
N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine has a molecular weight of 252.32 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-phenylethyl)-1H-imidazo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 79821248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).