N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide

C19H22N2O2 — CID 110362898

IUPACN-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide
SMILESCc1ccc(C(CNC(=O)C2CCCO2)c2ccccn2)cc1
InChIInChI=1S/C19H22N2O2/c1-14-7-9-15(10-8-14)16(17-5-2-3-11-20-17)13-21-19(22)18-6-4-12-23-18/h2-3,5,7-11,16,18H,4,6,12-13H2,1H3,(H,21,22)
InChIKeyNBQGVXMJEDBNSW-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.82
Rot. Bonds5

About N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide

N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide (PubChem CID 110362898) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide
PubChem CID110362898
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide
SMILESCc1ccc(C(CNC(=O)C2CCCO2)c2ccccn2)cc1
InChIInChI=1S/C19H22N2O2/c1-14-7-9-15(10-8-14)16(17-5-2-3-11-20-17)13-21-19(22)18-6-4-12-23-18/h2-3,5,7-11,16,18H,4,6,12-13H2,1H3,(H,21,22)
InChIKeyNBQGVXMJEDBNSW-UHFFFAOYSA-N
XLogP2.82
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-propan-2-ylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide
CID 110362967
(2R)-N-[(1S)-2-methyl-1-pyridin-2-ylpropyl]oxolane-2-carboxamide
CID 96504930
N-(2-phenylbutyl)oxolane-2-carboxamide
CID 78800794
N-(2-phenyl-2-pyridin-2-ylethyl)acetamide
CID 16927789
(2S)-N-[(2S)-2-[[(2R)-oxolane-2-carbonyl]amino]-3-phenylpropyl]oxolane-2-carboxamide
CID 100849813
[2-(4-chlorophenyl)-2-pyridin-2-ylethyl]carbamic acid
CID 155128689
N-(3-phenylbutyl)oxolane-2-carboxamide
CID 110357557
(2S)-N-[(1S)-1-phenylethyl]oxolane-2-carboxamide
CID 896917
N-(2-hydroxy-2-naphthalen-2-ylethyl)oxolane-2-carboxamide
CID 111112177
N-[2-(4-methylanilino)-2-oxoethyl]oxolane-2-carboxamide
CID 112996161
2,2-dimethyl-N-(2-phenyl-2-pyridin-2-ylethyl)propanamide
CID 16927739
(2R)-N-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]oxolane-2-carboxamide
CID 95100125

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide?
The IUPAC name of N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide (CID 110362898) is N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide?
The canonical SMILES for N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide is Cc1ccc(C(CNC(=O)C2CCCO2)c2ccccn2)cc1.
What is the InChIKey of N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide?
The InChIKey is NBQGVXMJEDBNSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-14-7-9-15(10-8-14)16(17-5-2-3-11-20-17)13-21-19(22)18-6-4-12-23-18/h2-3,5,7-11,16,18H,4,6,12-13H2,1H3,(H,21,22).
What are the key properties of N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide?
N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methylphenyl)-2-pyridin-2-ylethyl]oxolane-2-carboxamide is sourced from PubChem (CID 110362898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).