N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide

C17H26N2O3 — CID 94820014

IUPACN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide
SMILESCOc1c(C)cnc(CN(C)C(=O)CC[C@H]2CCCO2)c1C
InChIInChI=1S/C17H26N2O3/c1-12-10-18-15(13(2)17(12)21-4)11-19(3)16(20)8-7-14-6-5-9-22-14/h10,14H,5-9,11H2,1-4H3/t14-/m1/s1
InChIKeyVSONISSSQLEZGN-CQSZACIVSA-N
MW306.41 g/mol
LogP2.62
Rot. Bonds6

About N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide

N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide (PubChem CID 94820014) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide.

Molecular Properties

Compound NameN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide
PubChem CID94820014
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC NameN-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide
SMILESCOc1c(C)cnc(CN(C)C(=O)CC[C@H]2CCCO2)c1C
InChIInChI=1S/C17H26N2O3/c1-12-10-18-15(13(2)17(12)21-4)11-19(3)16(20)8-7-14-6-5-9-22-14/h10,14H,5-9,11H2,1-4H3/t14-/m1/s1
InChIKeyVSONISSSQLEZGN-CQSZACIVSA-N
XLogP2.62
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,4,5-trimethoxy-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylbenzamide
CID 51128958
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
CID 51100025
3-(2,2-dimethylcyclopentyl)-1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1-methylurea
CID 126788556
methyl 3-[methyl-[3-(oxolan-2-yl)propanoyl]amino]propanoate
CID 54979906
N-(2-hydroxyethyl)-N-methyl-3-(oxolan-2-yl)propanamide
CID 60749979
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-2-[(1S)-3-oxo-1,2-dihydroisoindol-1-yl]acetamide
CID 124757117
(2R)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N,2-dimethylpentanamide
CID 95316113
cis-(1S,2R)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-2-methylsulfonylcyclopentan-1-amine
CID 129424024
N-[[3-(aminomethyl)phenyl]methyl]-N-methyl-3-(oxolan-2-yl)propanamide
CID 65152460
3-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1-methylurea
CID 71882269
3-imidazo[1,2-a]pyridin-2-yl-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylpropanamide
CID 50948367
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N,3-dimethyl-4-oxo-6,7-dihydro-5H-1-benzofuran-2-carboxamide
CID 71881925

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide?
The IUPAC name of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide (CID 94820014) is N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide.
What is the SMILES notation for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide?
The canonical SMILES for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide is COc1c(C)cnc(CN(C)C(=O)CC[C@H]2CCCO2)c1C.
What is the InChIKey of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide?
The InChIKey is VSONISSSQLEZGN-CQSZACIVSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-12-10-18-15(13(2)17(12)21-4)11-19(3)16(20)8-7-14-6-5-9-22-14/h10,14H,5-9,11H2,1-4H3/t14-/m1/s1.
What are the key properties of N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide?
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide has a molecular weight of 306.41 g/mol, XLogP of 2.62, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methyl-3-[(2R)-oxolan-2-yl]propanamide is sourced from PubChem (CID 94820014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).