[2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol

C20H17ClN4O2 — CID 140914384

IUPAC[2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol
SMILESCOc1cc(CO)c(-c2cn3ccc(-c4cncc(N)c4)cc3n2)cc1Cl
InChIInChI=1S/C20H17ClN4O2/c1-27-19-5-14(11-26)16(7-17(19)21)18-10-25-3-2-12(6-20(25)24-18)13-4-15(22)9-23-8-13/h2-10,26H,11,22H2,1H3
InChIKeyLVEHRWDFOKGNFG-UHFFFAOYSA-N
MW380.84 g/mol
LogP3.80
Rot. Bonds4

About [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol

[2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol (PubChem CID 140914384) has the molecular formula C20H17ClN4O2 and a molecular weight of 380.84 g/mol. Its IUPAC name is [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol.

Molecular Properties

Compound Name[2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol
PubChem CID140914384
Molecular FormulaC20H17ClN4O2
Molecular Weight380.84 g/mol
Exact Mass380.10
IUPAC Name[2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol
SMILESCOc1cc(CO)c(-c2cn3ccc(-c4cncc(N)c4)cc3n2)cc1Cl
InChIInChI=1S/C20H17ClN4O2/c1-27-19-5-14(11-26)16(7-17(19)21)18-10-25-3-2-12(6-20(25)24-18)13-4-15(22)9-23-8-13/h2-10,26H,11,22H2,1H3
InChIKeyLVEHRWDFOKGNFG-UHFFFAOYSA-N
XLogP3.80
TPSA85.67 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.84
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(S)-1-(2-(5-Chloro-2,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-7-yl)-N-(pyridin-4-ylmethyl)pyrrolidin-3-amine
CID 135281262
6-chloro-2-(4-chloro-2-pyridinyl)-N-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridin-3-amine
CID 137650941
2-(4-chlorophenyl)-1-(4-methoxybenzyl)-1H-imidazo[1,2-a]pyridin-4-ium bromide
CID 12005558
2-Chloro-4-(3-methyl-3H-imidazo[4,5-b]pyridin-6-yl)phenyl alpha-D-mannopyranoside
CID 57523434
2-(4-chlorophenyl)-1-(4-methoxybenzyl)-1H-imidazo[1,2-a]pyridin-4-ium
CID 911460
4-{3-[(4-Chlorophenyl)amino]-6-methylimidazo[1,2-a]pyridin-2-yl}-2-methoxyphenol
CID 7338000
2-(3-chloro-4-ethoxyphenyl)-3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-6-amine
CID 44341223
2-chloro-5-[2-[1-[(4-methoxyphenyl)methylamino]-2-methylpropan-2-yl]-5-pyridin-4-yl-1H-imidazol-4-yl]phenol;hydrochloride
CID 44534817
2-chloro-5-[2-[1-[(3-methoxyphenyl)methylamino]-2-methylpropan-2-yl]-5-pyridin-4-yl-1H-imidazol-4-yl]phenol;hydrochloride
CID 44535081
3-(4-Chlorophenyl)-1-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridin-1-ium bromide
CID 45023420
6-(4-Chlorophenyl)-2-(3-methoxyphenyl)imidazo[1,2-a]pyridine
CID 155521184
1-[(3-Chloro-4-methoxyphenyl)methyl]-3-[6-[4-[(4-hydroxypiperidin-1-yl)methyl]phenyl]-2,8-dimethylimidazo[1,2-a]pyridin-3-yl]urea
CID 164616908

Frequently Asked Questions

What is the IUPAC name of [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol?
The IUPAC name of [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol (CID 140914384) is [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol.
What is the SMILES notation for [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol?
The canonical SMILES for [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol is COc1cc(CO)c(-c2cn3ccc(-c4cncc(N)c4)cc3n2)cc1Cl.
What is the InChIKey of [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol?
The InChIKey is LVEHRWDFOKGNFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O2/c1-27-19-5-14(11-26)16(7-17(19)21)18-10-25-3-2-12(6-20(25)24-18)13-4-15(22)9-23-8-13/h2-10,26H,11,22H2,1H3.
What are the key properties of [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol?
[2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol has a molecular weight of 380.84 g/mol, XLogP of 3.80, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[7-(5-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]-4-chloro-5-methoxyphenyl]methanol is sourced from PubChem (CID 140914384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).