[(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone

C16H22N4O2 — CID 176503964

IUPAC[(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone
SMILESCC(C)Cn1cnc2cc(C(=O)N3CCOC[C@H]3C)cnc21
InChIInChI=1S/C16H22N4O2/c1-11(2)8-19-10-18-14-6-13(7-17-15(14)19)16(21)20-4-5-22-9-12(20)3/h6-7,10-12H,4-5,8-9H2,1-3H3/t12-/m1/s1
InChIKeyOXTDNYYRCWANBC-GFCCVEGCSA-N
MW302.38 g/mol
LogP1.95
Rot. Bonds3

About [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone

[(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone (PubChem CID 176503964) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone.

Molecular Properties

Compound Name[(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone
PubChem CID176503964
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC Name[(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone
SMILESCC(C)Cn1cnc2cc(C(=O)N3CCOC[C@H]3C)cnc21
InChIInChI=1S/C16H22N4O2/c1-11(2)8-19-10-18-14-6-13(7-17-15(14)19)16(21)20-4-5-22-9-12(20)3/h6-7,10-12H,4-5,8-9H2,1-3H3/t12-/m1/s1
InChIKeyOXTDNYYRCWANBC-GFCCVEGCSA-N
XLogP1.95
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone with MolForge

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Related Compounds

[(4S,9aR)-4-phenyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[2,1-c][1,4]oxazin-8-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone
CID 176503776
[4-[1-(4-methylpiperazin-1-yl)ethyl]piperidin-1-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone
CID 176503662
N-methyl-N-(1-methylpiperidin-4-yl)-3-(2-methylpropyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 175642076
(6-amino-5-chloro-3-pyridinyl)-(3-methylmorpholin-4-yl)methanone
CID 55041929
(6-chloro-3-pyridinyl)-(3-methylmorpholin-4-yl)methanone
CID 43429048
(2-bromo-4-pyridinyl)-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106832524
3-[3-(2-methylpropyl)imidazo[4,5-b]pyridine-6-carbonyl]-3,10-diazaspiro[5.6]dodecan-9-one
CID 176500220
[2-(methylamino)-4-pyridinyl]-(3-methylmorpholin-4-yl)methanone
CID 55047498
3-(2-methylpropyl)-N-[(5-oxopyrrolidin-3-yl)methyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 176507089
methyl 2-[4-[[1-[3-(2-methylpropyl)imidazo[4,5-b]pyridine-6-carbonyl]pyrrolidin-3-yl]methyl]phenyl]acetate
CID 176501074
(3,4-difluorophenyl)-(3-methylmorpholin-4-yl)methanone
CID 110292238
1-[4-(3-methylmorpholine-4-carbonyl)phenyl]-3-(2-methylpropyl)urea
CID 110614358

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone?
The IUPAC name of [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone (CID 176503964) is [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone.
What is the SMILES notation for [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone?
The canonical SMILES for [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone is CC(C)Cn1cnc2cc(C(=O)N3CCOC[C@H]3C)cnc21.
What is the InChIKey of [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone?
The InChIKey is OXTDNYYRCWANBC-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-11(2)8-19-10-18-14-6-13(7-17-15(14)19)16(21)20-4-5-22-9-12(20)3/h6-7,10-12H,4-5,8-9H2,1-3H3/t12-/m1/s1.
What are the key properties of [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone?
[(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone has a molecular weight of 302.38 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-methylmorpholin-4-yl]-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-6-yl]methanone is sourced from PubChem (CID 176503964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).