N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide

C20H25N3O3 — CID 94083483

IUPACN-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide
SMILESO=C(NC[C@H]([C@H]1CCOC1)N1CCOCC1)c1ccc2ccccc2n1
InChIInChI=1S/C20H25N3O3/c24-20(18-6-5-15-3-1-2-4-17(15)22-18)21-13-19(16-7-10-26-14-16)23-8-11-25-12-9-23/h1-6,16,19H,7-14H2,(H,21,24)/t16-,19+/m0/s1
InChIKeyMYPUZJGWVXRPDO-QFBILLFUSA-N
MW355.44 g/mol
LogP1.70
Rot. Bonds5

About N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide

N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide (PubChem CID 94083483) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide
PubChem CID94083483
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC NameN-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide
SMILESO=C(NC[C@H]([C@H]1CCOC1)N1CCOCC1)c1ccc2ccccc2n1
InChIInChI=1S/C20H25N3O3/c24-20(18-6-5-15-3-1-2-4-17(15)22-18)21-13-19(16-7-10-26-14-16)23-8-11-25-12-9-23/h1-6,16,19H,7-14H2,(H,21,24)/t16-,19+/m0/s1
InChIKeyMYPUZJGWVXRPDO-QFBILLFUSA-N
XLogP1.70
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 94021743
5-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-1,2-oxazole-3-carboxamide
CID 94022952
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94083431
2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
CID 55642293
(2S)-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-2-phenylbutanamide
CID 94150246
2-methoxy-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]pyridine-3-carboxamide
CID 94024269
2-(4-methylphenyl)-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]acetamide
CID 94150138
1-(2-chlorophenyl)-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55696727
1-[cyclopropyl(phenyl)methyl]-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55590697
5-ethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94021730
1-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-3-pyridin-4-ylurea
CID 94030463
1,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
CID 94021725

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide?
The IUPAC name of N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide (CID 94083483) is N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide.
What is the SMILES notation for N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide?
The canonical SMILES for N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide is O=C(NC[C@H]([C@H]1CCOC1)N1CCOCC1)c1ccc2ccccc2n1.
What is the InChIKey of N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide?
The InChIKey is MYPUZJGWVXRPDO-QFBILLFUSA-N. The full InChI is InChI=1S/C20H25N3O3/c24-20(18-6-5-15-3-1-2-4-17(15)22-18)21-13-19(16-7-10-26-14-16)23-8-11-25-12-9-23/h1-6,16,19H,7-14H2,(H,21,24)/t16-,19+/m0/s1.
What are the key properties of N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide?
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]quinoline-2-carboxamide is sourced from PubChem (CID 94083483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).