[2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol

C19H22ClN5O2 — CID 140914799

IUPAC[2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol
SMILESCOc1cc(CO)c(-c2cn3ccc(N4CCC(N)CC4)nc3n2)cc1Cl
InChIInChI=1S/C19H22ClN5O2/c1-27-17-8-12(11-26)14(9-15(17)20)16-10-25-7-4-18(23-19(25)22-16)24-5-2-13(21)3-6-24/h4,7-10,13,26H,2-3,5-6,11,21H2,1H3
InChIKeyKPFFHQOHJHBWEF-UHFFFAOYSA-N
MW387.87 g/mol
LogP2.48
Rot. Bonds4

About [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol

[2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol (PubChem CID 140914799) has the molecular formula C19H22ClN5O2 and a molecular weight of 387.87 g/mol. Its IUPAC name is [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol.

Molecular Properties

Compound Name[2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol
PubChem CID140914799
Molecular FormulaC19H22ClN5O2
Molecular Weight387.87 g/mol
Exact Mass387.15
IUPAC Name[2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol
SMILESCOc1cc(CO)c(-c2cn3ccc(N4CCC(N)CC4)nc3n2)cc1Cl
InChIInChI=1S/C19H22ClN5O2/c1-27-17-8-12(11-26)14(9-15(17)20)16-10-25-7-4-18(23-19(25)22-16)24-5-2-13(21)3-6-24/h4,7-10,13,26H,2-3,5-6,11,21H2,1H3
InChIKeyKPFFHQOHJHBWEF-UHFFFAOYSA-N
XLogP2.48
TPSA88.91 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.87
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-chloro-2-[7-(4-cyclopropylsulfonylpiperazin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-5-methoxyphenyl]methanol
CID 140914558
(3R)-1-[2-(5-chloro-2,4-dimethoxyphenyl)imidazo[1,2-a]pyrimidin-7-yl]pyrrolidin-3-amine
CID 135335362
(3R)-1-[2-(5-chloro-2,4-dimethoxyphenyl)imidazo[1,2-a]pyrimidin-7-yl]pyrrolidin-3-amine;hydrochloride
CID 135335613
4-[2-[5-chloro-2-(hydroxymethyl)-4-methoxyphenyl]imidazo[1,2-a]pyrimidin-7-yl]-N,N-dimethylpiperazine-1-sulfonamide
CID 140914571
[2-(7-aminoimidazo[1,2-a]pyrimidin-2-yl)-4-chloro-5-methoxyphenyl]methanol
CID 140914464
2-(5-chloro-2,4-dimethoxyphenyl)-7-(4-cyclopentylsulfonylpiperazin-1-yl)imidazo[1,2-a]pyrimidine
CID 135334869
[1-[2-[5-chloro-2-(hydroxymethyl)-4-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]piperidin-4-yl] formate
CID 140914849
2-(5-chloro-4-methoxy-2-phenylmethoxyphenyl)-7-piperidin-1-ylimidazo[1,2-a]pyrimidine
CID 159661516
tert-butyl N-[1-[2-[5-bromo-2-(hydroxymethyl)-4-methoxyphenyl]imidazo[1,2-a]pyrimidin-7-yl]pyrrolidin-3-yl]carbamate
CID 154702275
[4-chloro-2-[7-[4-(cyclopentylmethyl)-1,4-diazepan-1-yl]imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenyl]methanol
CID 140914663
1-[2-[5-chloro-2-(hydroxymethyl)-4-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]-N-phenylpiperidine-4-carboxamide
CID 140914841
[4-chloro-2-[7-[4-(cyclohexylmethyl)-1,4-diazepan-1-yl]imidazo[1,2-a]pyridin-2-yl]-5-methoxyphenyl]methanol
CID 140914446

Frequently Asked Questions

What is the IUPAC name of [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol?
The IUPAC name of [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol (CID 140914799) is [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol.
What is the SMILES notation for [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol?
The canonical SMILES for [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol is COc1cc(CO)c(-c2cn3ccc(N4CCC(N)CC4)nc3n2)cc1Cl.
What is the InChIKey of [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol?
The InChIKey is KPFFHQOHJHBWEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClN5O2/c1-27-17-8-12(11-26)14(9-15(17)20)16-10-25-7-4-18(23-19(25)22-16)24-5-2-13(21)3-6-24/h4,7-10,13,26H,2-3,5-6,11,21H2,1H3.
What are the key properties of [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol?
[2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol has a molecular weight of 387.87 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[7-(4-aminopiperidin-1-yl)imidazo[1,2-a]pyrimidin-2-yl]-4-chloro-5-methoxyphenyl]methanol is sourced from PubChem (CID 140914799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).