(2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide

C19H22N2O2 — CID 136586841

IUPAC(2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide
SMILESCc1cnc(CNC(=O)[C@@H]2CCO[C@H]2c2ccccc2)c(C)c1
InChIInChI=1S/C19H22N2O2/c1-13-10-14(2)17(20-11-13)12-21-19(22)16-8-9-23-18(16)15-6-4-3-5-7-15/h3-7,10-11,16,18H,8-9,12H2,1-2H3,(H,21,22)/t16-,18+/m1/s1
InChIKeyPGDIKBLELUCJOB-AEFFLSMTSA-N
MW310.40 g/mol
LogP3.09
Rot. Bonds4

About (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide

(2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide (PubChem CID 136586841) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide.

Molecular Properties

Compound Name(2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide
PubChem CID136586841
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name(2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide
SMILESCc1cnc(CNC(=O)[C@@H]2CCO[C@H]2c2ccccc2)c(C)c1
InChIInChI=1S/C19H22N2O2/c1-13-10-14(2)17(20-11-13)12-21-19(22)16-8-9-23-18(16)15-6-4-3-5-7-15/h3-7,10-11,16,18H,8-9,12H2,1-2H3,(H,21,22)/t16-,18+/m1/s1
InChIKeyPGDIKBLELUCJOB-AEFFLSMTSA-N
XLogP3.09
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3R)-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-phenyloxolane-3-carboxamide
CID 136587872
(2S,3S)-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-phenyloxolane-3-carboxamide
CID 164630958
2-phenyloxolane-3-carbohydrazide
CID 122235516
(2R,3S)-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-phenyloxane-3-carboxamide
CID 97067524
(2R,3R)-2-(2-methylpyrazol-3-yl)-N-[(5-methyl-3-pyridinyl)methyl]oxolane-3-carboxamide
CID 128966406
2-methyl-5-[[[(2R,3R)-2-phenyloxane-3-carbonyl]amino]methyl]furan-3-carboxylic acid
CID 125148950
2-[[(2S,3S)-2-(4-methylphenyl)oxane-3-carbonyl]amino]acetic acid
CID 125151438
5-methyl-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]pyrazine-2-carboxamide
CID 129000874
phenyl-(2-phenyloxolan-3-yl)methanone
CID 73097073
N-(2-amino-2-cyclopropylethyl)-2-phenyloxane-3-carboxamide
CID 115301019
(2S,3S)-N-[(2R)-2-methyl-3-(2-methylimidazol-1-yl)propyl]-2-(1-phenylpyrazol-4-yl)oxolane-3-carboxamide
CID 129323627
5-[[(2-methyloxolane-3-carbonyl)amino]methyl]pyridine-2-carboxylic acid
CID 81099650

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide?
The IUPAC name of (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide (CID 136586841) is (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide.
What is the SMILES notation for (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide?
The canonical SMILES for (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide is Cc1cnc(CNC(=O)[C@@H]2CCO[C@H]2c2ccccc2)c(C)c1.
What is the InChIKey of (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide?
The InChIKey is PGDIKBLELUCJOB-AEFFLSMTSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-13-10-14(2)17(20-11-13)12-21-19(22)16-8-9-23-18(16)15-6-4-3-5-7-15/h3-7,10-11,16,18H,8-9,12H2,1-2H3,(H,21,22)/t16-,18+/m1/s1.
What are the key properties of (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide?
(2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-N-[(3,5-dimethyl-2-pyridinyl)methyl]-2-phenyloxolane-3-carboxamide is sourced from PubChem (CID 136586841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).