N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide

C23H24N2O2 — CID 42789365

IUPACN-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide
SMILESO=C(C1CCCO1)N(CCc1ccccc1)Cc1ccc2ccccc2n1
InChIInChI=1S/C23H24N2O2/c26-23(22-11-6-16-27-22)25(15-14-18-7-2-1-3-8-18)17-20-13-12-19-9-4-5-10-21(19)24-20/h1-5,7-10,12-13,22H,6,11,14-17H2
InChIKeyYTEFSTFTMUNSKI-UHFFFAOYSA-N
MW360.46 g/mol
LogP3.99
Rot. Bonds6

About N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide

N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide (PubChem CID 42789365) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide
PubChem CID42789365
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC NameN-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide
SMILESO=C(C1CCCO1)N(CCc1ccccc1)Cc1ccc2ccccc2n1
InChIInChI=1S/C23H24N2O2/c26-23(22-11-6-16-27-22)25(15-14-18-7-2-1-3-8-18)17-20-13-12-19-9-4-5-10-21(19)24-20/h1-5,7-10,12-13,22H,6,11,14-17H2
InChIKeyYTEFSTFTMUNSKI-UHFFFAOYSA-N
XLogP3.99
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide
CID 42796822
(2R)-N-benzyl-N-(3,3,3-trifluoropropyl)oxolane-2-carboxamide
CID 99834856
(2S)-N-[(3-chlorophenyl)methyl]-N-(2-hydroxyethyl)oxolane-2-carboxamide
CID 91662725
trans-(1R,2R)-1-N,2-N-dibenzyl-1-N,2-N-bis(quinolin-2-ylmethyl)cyclohexane-1,2-diamine
CID 102375757
(2S)-N-(2-amino-2-oxoethyl)-N-[(4-phenylphenyl)methyl]oxolane-2-carboxamide
CID 94537928
N-benzyl-N-[2-(4-methoxyphenyl)ethyl]morpholine-2-carboxamide
CID 119770882
N-(2-phenylethyl)-N-(pyridin-2-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 42778763
1-phenyl-N,N-bis(quinolin-2-ylmethyl)methanamine
CID 86023570
N-[[3-[2-(dimethylamino)ethoxy]phenyl]methyl]-N-(pyridin-2-ylmethyl)oxolane-2-carboxamide
CID 45169703
2-quinolin-2-yloxane-3-carboxylic acid
CID 79367752
3-(N-[(2R)-oxolane-2-carbonyl]anilino)propanoic acid
CID 93332713
oxolan-2-yl-(4-quinolin-2-ylpiperazin-1-yl)methanone
CID 108741501

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide?
The IUPAC name of N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide (CID 42789365) is N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide?
The canonical SMILES for N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide is O=C(C1CCCO1)N(CCc1ccccc1)Cc1ccc2ccccc2n1.
What is the InChIKey of N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide?
The InChIKey is YTEFSTFTMUNSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c26-23(22-11-6-16-27-22)25(15-14-18-7-2-1-3-8-18)17-20-13-12-19-9-4-5-10-21(19)24-20/h1-5,7-10,12-13,22H,6,11,14-17H2.
What are the key properties of N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide?
N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide has a molecular weight of 360.46 g/mol, XLogP of 3.99, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide is sourced from PubChem (CID 42789365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).