N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide

C21H30N4O3 — CID 127042087

IUPACN-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NCC2CN(C3CCOCC3)CCO2)c2ccccn12
InChIInChI=1S/C21H30N4O3/c1-15(2)20-23-19(18-5-3-4-8-25(18)20)21(26)22-13-17-14-24(9-12-28-17)16-6-10-27-11-7-16/h3-5,8,15-17H,6-7,9-14H2,1-2H3,(H,22,26)
InChIKeyHVNRSJACLYLTGO-UHFFFAOYSA-N
MW386.50 g/mol
LogP2.07
Rot. Bonds5

About N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide

N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 127042087) has the molecular formula C21H30N4O3 and a molecular weight of 386.50 g/mol. Its IUPAC name is N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID127042087
Molecular FormulaC21H30N4O3
Molecular Weight386.50 g/mol
Exact Mass386.23
IUPAC NameN-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NCC2CN(C3CCOCC3)CCO2)c2ccccn12
InChIInChI=1S/C21H30N4O3/c1-15(2)20-23-19(18-5-3-4-8-25(18)20)21(26)22-13-17-14-24(9-12-28-17)16-6-10-27-11-7-16/h3-5,8,15-17H,6-7,9-14H2,1-2H3,(H,22,26)
InChIKeyHVNRSJACLYLTGO-UHFFFAOYSA-N
XLogP2.07
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-[[4-[4-[[(3~{R},4~{R})-3-azanyloxan-4-yl]amino]pyrazol-1-yl]pyrimidin-2-yl]amino]-~{N},3-dimethyl-imidazo[1,5-a]pyridine-1-carboxamide
CID 155925934
6-cyclopropyl-N-[2-[methyl(oxan-4-yl)carbamoyl]-3-pyridinyl]-3-(pyrimidin-5-ylamino)pyrazine-2-carboxamide
CID 58548348
7-[2-(Oxan-4-Ylamino)pyrimidin-4-Yl]-3,4-Dihydro-2~{h}-Pyrrolo[1,2-A]pyrazin-1-One
CID 126480566
N-[[1-(oxan-4-ylmethyl)piperidin-4-yl]methyl]-2-propan-2-ylimidazo[1,2-a]pyridine-8-carboxamide
CID 77105903
N-[[1-[(4-hydroxyoxan-4-yl)methyl]piperidin-4-yl]methyl]-2-propan-2-ylimidazo[1,2-a]pyridine-8-carboxamide
CID 145965246
Morpholin-4-yl-[3-[6-(piperidin-4-ylamino)-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]methanone
CID 44448942
N-((1-(hydroxymethyl)cyclopentyl)methyl)-3-morpholinoimidazo[1,5-a]pyridine-1-carboxamide
CID 52918122
3-cyclopropyl-N-neopentylimidazo[1,5-a]pyridine-1-carboxamide
CID 54580175
(R)-3-morpholino-N-(2,2,2-trifluoro-1-(pyridin-2-yl)ethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 54581168
3-cyclopropyl-N-(dicyclopropylmethyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 54584153
3-((4,4-difluoropiperidin-1-yl)methyl)-N-((1-(hydroxymethyl)cyclopentyl)methyl)imidazo[1,5-a]pyridine-1-carboxamide
CID 54585088
3-(4-methoxybutyl)-N-(2-methylpropyl)-N-[(3S,5R)-5-(morpholine-4-carbonyl)piperidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide
CID 58355573

Frequently Asked Questions

What is the IUPAC name of N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (CID 127042087) is N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is CC(C)c1nc(C(=O)NCC2CN(C3CCOCC3)CCO2)c2ccccn12.
What is the InChIKey of N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is HVNRSJACLYLTGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O3/c1-15(2)20-23-19(18-5-3-4-8-25(18)20)21(26)22-13-17-14-24(9-12-28-17)16-6-10-27-11-7-16/h3-5,8,15-17H,6-7,9-14H2,1-2H3,(H,22,26).
What are the key properties of N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 386.50 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(oxan-4-yl)morpholin-2-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 127042087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).