N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine

C20H22FN3O — CID 59579175

IUPACN-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1cccc(F)c1-c1nc2cccc(C)n2c1NC1CCCC1
InChIInChI=1S/C20H22FN3O/c1-13-7-5-12-17-23-19(18-15(21)10-6-11-16(18)25-2)20(24(13)17)22-14-8-3-4-9-14/h5-7,10-12,14,22H,3-4,8-9H2,1-2H3
InChIKeyNBZPKBVFUBDPPY-UHFFFAOYSA-N
MW339.41 g/mol
LogP4.81
Rot. Bonds4

About N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine

N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 59579175) has the molecular formula C20H22FN3O and a molecular weight of 339.41 g/mol. Its IUPAC name is N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID59579175
Molecular FormulaC20H22FN3O
Molecular Weight339.41 g/mol
Exact Mass339.17
IUPAC NameN-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
SMILESCOc1cccc(F)c1-c1nc2cccc(C)n2c1NC1CCCC1
InChIInChI=1S/C20H22FN3O/c1-13-7-5-12-17-23-19(18-15(21)10-6-11-16(18)25-2)20(24(13)17)22-14-8-3-4-9-14/h5-7,10-12,14,22H,3-4,8-9H2,1-2H3
InChIKeyNBZPKBVFUBDPPY-UHFFFAOYSA-N
XLogP4.81
TPSA38.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.41
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine (CID 59579175) is N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine is COc1cccc(F)c1-c1nc2cccc(C)n2c1NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is NBZPKBVFUBDPPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22FN3O/c1-13-7-5-12-17-23-19(18-15(21)10-6-11-16(18)25-2)20(24(13)17)22-14-8-3-4-9-14/h5-7,10-12,14,22H,3-4,8-9H2,1-2H3.
What are the key properties of N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine?
N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 339.41 g/mol, XLogP of 4.81, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(2-fluoro-6-methoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 59579175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).