(2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide

C21H21N3O2 — CID 95138736

IUPAC(2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
SMILESO=C(N[C@@H]1CCc2nccn2C1)[C@@H](Oc1ccccc1)c1ccccc1
InChIInChI=1S/C21H21N3O2/c25-21(23-17-11-12-19-22-13-14-24(19)15-17)20(16-7-3-1-4-8-16)26-18-9-5-2-6-10-18/h1-10,13-14,17,20H,11-12,15H2,(H,23,25)/t17-,20+/m1/s1
InChIKeyUXOQYDSYBMCDQY-XLIONFOSSA-N
MW347.42 g/mol
LogP3.13
Rot. Bonds5

About (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide

(2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide (PubChem CID 95138736) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide.

Molecular Properties

Compound Name(2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
PubChem CID95138736
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name(2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
SMILESO=C(N[C@@H]1CCc2nccn2C1)[C@@H](Oc1ccccc1)c1ccccc1
InChIInChI=1S/C21H21N3O2/c25-21(23-17-11-12-19-22-13-14-24(19)15-17)20(16-7-3-1-4-8-16)26-18-9-5-2-6-10-18/h1-10,13-14,17,20H,11-12,15H2,(H,23,25)/t17-,20+/m1/s1
InChIKeyUXOQYDSYBMCDQY-XLIONFOSSA-N
XLogP3.13
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-phenoxy-2-phenyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95138739
(2R)-2-cyclopentyloxy-2-phenyl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95789758
2-methylsulfonyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)propanamide
CID 154775634
(2R)-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-thiophen-2-ylpropanamide
CID 95773661
(2S)-2-methoxy-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-phenylacetamide
CID 95765920
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-phenoxy-2-phenylacetamide;hydrochloride
CID 119457115
(1R)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2,3-dihydro-1H-indene-1-carboxamide
CID 95761037
(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 96516852
(2S)-N-cyclopropyl-2-(3,4-dichlorophenoxy)-2-phenylacetamide
CID 9417632
2-methoxy-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
CID 86771999
2-[(3-methoxyphenyl)methoxy]-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
CID 86772151
(1S)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide
CID 95134787

Frequently Asked Questions

What is the IUPAC name of (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide?
The IUPAC name of (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide (CID 95138736) is (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide.
What is the SMILES notation for (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide?
The canonical SMILES for (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide is O=C(N[C@@H]1CCc2nccn2C1)[C@@H](Oc1ccccc1)c1ccccc1.
What is the InChIKey of (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide?
The InChIKey is UXOQYDSYBMCDQY-XLIONFOSSA-N. The full InChI is InChI=1S/C21H21N3O2/c25-21(23-17-11-12-19-22-13-14-24(19)15-17)20(16-7-3-1-4-8-16)26-18-9-5-2-6-10-18/h1-10,13-14,17,20H,11-12,15H2,(H,23,25)/t17-,20+/m1/s1.
What are the key properties of (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide?
(2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide has a molecular weight of 347.42 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-phenoxy-2-phenyl-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide is sourced from PubChem (CID 95138736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).