N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide

C16H25N3O2 — CID 129333400

IUPACN-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide
SMILESCN(C[C@H]1CCn2ccnc2C1)C(=O)C[C@@H]1CCCCO1
InChIInChI=1S/C16H25N3O2/c1-18(16(20)11-14-4-2-3-9-21-14)12-13-5-7-19-8-6-17-15(19)10-13/h6,8,13-14H,2-5,7,9-12H2,1H3/t13-,14-/m0/s1
InChIKeyMFRLDAQEUHZLBQ-KBPBESRZSA-N
MW291.39 g/mol
LogP1.86
Rot. Bonds4

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

N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide (PubChem CID 129333400) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide
PubChem CID129333400
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide
SMILESCN(C[C@H]1CCn2ccnc2C1)C(=O)C[C@@H]1CCCCO1
InChIInChI=1S/C16H25N3O2/c1-18(16(20)11-14-4-2-3-9-21-14)12-13-5-7-19-8-6-17-15(19)10-13/h6,8,13-14H,2-5,7,9-12H2,1H3/t13-,14-/m0/s1
InChIKeyMFRLDAQEUHZLBQ-KBPBESRZSA-N
XLogP1.86
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclohexyloxy-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide
CID 129333684
N,4-dimethyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)morpholine-2-carboxamide
CID 128966976
N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)-3,4-dihydro-2H-pyran-5-carboxamide
CID 129000344
N,3-dimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]furan-2-carboxamide
CID 129337216
4-ethyl-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]benzamide
CID 129329539
N-methyl-2-(2-oxo-1-pyridinyl)-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide
CID 129328998
N-methyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-ylmethyl)pyridine-3-carboxamide
CID 128993290
1-methyl-3-(4-methyl-1,2-oxazol-3-yl)-1-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]urea
CID 129328569
N,2,4-trimethyl-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1,3-thiazole-5-carboxamide
CID 129336482
2-(1-ethylpiperidin-4-yl)-N-methyl-N-[[(2R)-oxan-2-yl]methyl]acetamide
CID 95124154
2-[(2R)-oxolan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]ethanesulfonamide
CID 129340231
N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indazole-5-carboxamide
CID 129340487

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide?
The IUPAC name of N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide (CID 129333400) is N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide.
What is the SMILES notation for N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide?
The canonical SMILES for N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide is CN(C[C@H]1CCn2ccnc2C1)C(=O)C[C@@H]1CCCCO1.
What is the InChIKey of N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide?
The InChIKey is MFRLDAQEUHZLBQ-KBPBESRZSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-18(16(20)11-14-4-2-3-9-21-14)12-13-5-7-19-8-6-17-15(19)10-13/h6,8,13-14H,2-5,7,9-12H2,1H3/t13-,14-/m0/s1.
What are the key properties of N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide?
N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide has a molecular weight of 291.39 g/mol, XLogP of 1.86, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(2S)-oxan-2-yl]-N-[[(7S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]acetamide is sourced from PubChem (CID 129333400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).