azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone

C20H26N4O3 — CID 92632850

IUPACazepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone
SMILESCc1cccn2cc(C(=O)N3CCO[C@H](C(=O)N4CCCCCC4)C3)nc12
InChIInChI=1S/C20H26N4O3/c1-15-7-6-10-23-13-16(21-18(15)23)19(25)24-11-12-27-17(14-24)20(26)22-8-4-2-3-5-9-22/h6-7,10,13,17H,2-5,8-9,11-12,14H2,1H3/t17-/m0/s1
InChIKeyYJBPYYMPQVFPEK-KRWDZBQOSA-N
MW370.45 g/mol
LogP1.89
Rot. Bonds2

About azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone

azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone (PubChem CID 92632850) has the molecular formula C20H26N4O3 and a molecular weight of 370.45 g/mol. Its IUPAC name is azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone.

Molecular Properties

Compound Nameazepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone
PubChem CID92632850
Molecular FormulaC20H26N4O3
Molecular Weight370.45 g/mol
Exact Mass370.20
IUPAC Nameazepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone
SMILESCc1cccn2cc(C(=O)N3CCO[C@H](C(=O)N4CCCCCC4)C3)nc12
InChIInChI=1S/C20H26N4O3/c1-15-7-6-10-23-13-16(21-18(15)23)19(25)24-11-12-27-17(14-24)20(26)22-8-4-2-3-5-9-22/h6-7,10,13,17H,2-5,8-9,11-12,14H2,1H3/t17-/m0/s1
InChIKeyYJBPYYMPQVFPEK-KRWDZBQOSA-N
XLogP1.89
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-dihydro-1H-isoquinolin-2-yl-[4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone
CID 110246696
(4-chlorophenyl)-[(3S)-1-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)piperidin-3-yl]methanone
CID 42098520
(3R)-N-cyclopentyl-1-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)pyrrolidine-3-carboxamide
CID 92635367
[(2S)-2-[6-[(2-chlorophenyl)methyl]-2-pyridinyl]morpholin-4-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 125007104
(8-methylimidazo[1,2-a]pyridin-2-yl)-piperazin-1-ylmethanone
CID 39162238
(8-methylimidazo[1,2-a]pyridin-2-yl)-[(3S)-3-(4-phenyl-1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 95222377
[2-[6-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]morpholin-4-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 110093050
(8-methylimidazo[1,2-a]pyridin-2-yl)-[(2R)-2-methyl-2-(morpholine-4-carbonyl)pyrrolidin-1-yl]methanone
CID 92632340
[3-(1-ethylimidazol-2-yl)piperidin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 74240001
[3-[4-(aminomethyl)triazol-1-yl]piperidin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone
CID 167786897
[(2R)-4-(2-ethylpyrazole-3-carbonyl)morpholin-2-yl]-piperidin-1-ylmethanone
CID 92632860
(8-methylimidazo[1,2-a]pyridin-2-yl)-spiro[4,5-dihydro-1H-cyclopenta[d]pyrazole-6,3'-piperidine]-1'-ylmethanone
CID 138806654

Frequently Asked Questions

What is the IUPAC name of azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone?
The IUPAC name of azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone (CID 92632850) is azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone.
What is the SMILES notation for azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone?
The canonical SMILES for azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone is Cc1cccn2cc(C(=O)N3CCO[C@H](C(=O)N4CCCCCC4)C3)nc12.
What is the InChIKey of azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone?
The InChIKey is YJBPYYMPQVFPEK-KRWDZBQOSA-N. The full InChI is InChI=1S/C20H26N4O3/c1-15-7-6-10-23-13-16(21-18(15)23)19(25)24-11-12-27-17(14-24)20(26)22-8-4-2-3-5-9-22/h6-7,10,13,17H,2-5,8-9,11-12,14H2,1H3/t17-/m0/s1.
What are the key properties of azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone?
azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone has a molecular weight of 370.45 g/mol, XLogP of 1.89, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azepan-1-yl-[(2S)-4-(8-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholin-2-yl]methanone is sourced from PubChem (CID 92632850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).