7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide

C21H23N3O3 — CID 92562598

IUPAC7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccn2cc(C(=O)NCc3cccc(OC[C@@H]4CCCO4)c3)nc2c1
InChIInChI=1S/C21H23N3O3/c1-15-7-8-24-13-19(23-20(24)10-15)21(25)22-12-16-4-2-5-17(11-16)27-14-18-6-3-9-26-18/h2,4-5,7-8,10-11,13,18H,3,6,9,12,14H2,1H3,(H,22,25)/t18-/m0/s1
InChIKeyFIGXXOIKYNGDAZ-SFHVURJKSA-N
MW365.43 g/mol
LogP3.13
Rot. Bonds6

About 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide

7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 92562598) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID92562598
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC Name7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccn2cc(C(=O)NCc3cccc(OC[C@@H]4CCCO4)c3)nc2c1
InChIInChI=1S/C21H23N3O3/c1-15-7-8-24-13-19(23-20(24)10-15)21(25)22-12-16-4-2-5-17(11-16)27-14-18-6-3-9-26-18/h2,4-5,7-8,10-11,13,18H,3,6,9,12,14H2,1H3,(H,22,25)/t18-/m0/s1
InChIKeyFIGXXOIKYNGDAZ-SFHVURJKSA-N
XLogP3.13
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 92562598) is 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide is Cc1ccn2cc(C(=O)NCc3cccc(OC[C@@H]4CCCO4)c3)nc2c1.
What is the InChIKey of 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is FIGXXOIKYNGDAZ-SFHVURJKSA-N. The full InChI is InChI=1S/C21H23N3O3/c1-15-7-8-24-13-19(23-20(24)10-15)21(25)22-12-16-4-2-5-17(11-16)27-14-18-6-3-9-26-18/h2,4-5,7-8,10-11,13,18H,3,6,9,12,14H2,1H3,(H,22,25)/t18-/m0/s1.
What are the key properties of 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide?
7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 365.43 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-[[3-[[(2S)-oxolan-2-yl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 92562598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).