N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine

C21H25N3O2 — CID 1139308

IUPACN-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1cccc(-c2nc3cc(C)ccn3c2NC2CCCC2)c1OC
InChIInChI=1S/C21H25N3O2/c1-14-11-12-24-18(13-14)23-19(21(24)22-15-7-4-5-8-15)16-9-6-10-17(25-2)20(16)26-3/h6,9-13,15,22H,4-5,7-8H2,1-3H3
InChIKeyQQGBKQAYTSLZCK-UHFFFAOYSA-N
MW351.45 g/mol
LogP4.68
Rot. Bonds5

About N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine

N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 1139308) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID1139308
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC NameN-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1cccc(-c2nc3cc(C)ccn3c2NC2CCCC2)c1OC
InChIInChI=1S/C21H25N3O2/c1-14-11-12-24-18(13-14)23-19(21(24)22-15-7-4-5-8-15)16-9-6-10-17(25-2)20(16)26-3/h6,9-13,15,22H,4-5,7-8H2,1-3H3
InChIKeyQQGBKQAYTSLZCK-UHFFFAOYSA-N
XLogP4.68
TPSA47.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine (CID 1139308) is N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine is COc1cccc(-c2nc3cc(C)ccn3c2NC2CCCC2)c1OC.
What is the InChIKey of N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is QQGBKQAYTSLZCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-14-11-12-24-18(13-14)23-19(21(24)22-15-7-4-5-8-15)16-9-6-10-17(25-2)20(16)26-3/h6,9-13,15,22H,4-5,7-8H2,1-3H3.
What are the key properties of N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine?
N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 351.45 g/mol, XLogP of 4.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(2,3-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 1139308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).