[(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone

C19H21N5O2 — CID 125018231

IUPAC[(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCNc1cccc([C@@H]2CN(C(=O)c3cn4cc(C)ccc4n3)CCO2)n1
InChIInChI=1S/C19H21N5O2/c1-13-6-7-18-22-15(11-24(18)10-13)19(25)23-8-9-26-16(12-23)14-4-3-5-17(20-2)21-14/h3-7,10-11,16H,8-9,12H2,1-2H3,(H,20,21)/t16-/m0/s1
InChIKeyXNGUHUXDLXXKRV-INIZCTEOSA-N
MW351.41 g/mol
LogP2.29
Rot. Bonds3

About [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone

[(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone (PubChem CID 125018231) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone.

Molecular Properties

Compound Name[(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
PubChem CID125018231
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name[(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCNc1cccc([C@@H]2CN(C(=O)c3cn4cc(C)ccc4n3)CCO2)n1
InChIInChI=1S/C19H21N5O2/c1-13-6-7-18-22-15(11-24(18)10-13)19(25)23-8-9-26-16(12-23)14-4-3-5-17(20-2)21-14/h3-7,10-11,16H,8-9,12H2,1-2H3,(H,20,21)/t16-/m0/s1
InChIKeyXNGUHUXDLXXKRV-INIZCTEOSA-N
XLogP2.29
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The IUPAC name of [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone (CID 125018231) is [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone.
What is the SMILES notation for [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The canonical SMILES for [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone is CNc1cccc([C@@H]2CN(C(=O)c3cn4cc(C)ccc4n3)CCO2)n1.
What is the InChIKey of [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The InChIKey is XNGUHUXDLXXKRV-INIZCTEOSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-13-6-7-18-22-15(11-24(18)10-13)19(25)23-8-9-26-16(12-23)14-4-3-5-17(20-2)21-14/h3-7,10-11,16H,8-9,12H2,1-2H3,(H,20,21)/t16-/m0/s1.
What are the key properties of [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone?
[(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone has a molecular weight of 351.41 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(6-methylimidazo[1,2-a]pyridin-2-yl)methanone is sourced from PubChem (CID 125018231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).