(3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide

C24H24N4O3 — CID 93276407

IUPAC(3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cn1)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1
InChIInChI=1S/C24H24N4O3/c29-23-14-18(16-28(23)21-7-3-5-17-4-1-2-6-20(17)21)24(30)26-22-9-8-19(15-25-22)27-10-12-31-13-11-27/h1-9,15,18H,10-14,16H2,(H,25,26,30)/t18-/m1/s1
InChIKeyNKRABSTXFJLSIY-GOSISDBHSA-N
MW416.48 g/mol
LogP3.06
Rot. Bonds4

About (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide

(3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide (PubChem CID 93276407) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
PubChem CID93276407
Molecular FormulaC24H24N4O3
Molecular Weight416.48 g/mol
Exact Mass416.18
IUPAC Name(3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)cn1)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1
InChIInChI=1S/C24H24N4O3/c29-23-14-18(16-28(23)21-7-3-5-17-4-1-2-6-20(17)21)24(30)26-22-9-8-19(15-25-22)27-10-12-31-13-11-27/h1-9,15,18H,10-14,16H2,(H,25,26,30)/t18-/m1/s1
InChIKeyNKRABSTXFJLSIY-GOSISDBHSA-N
XLogP3.06
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3S)-N-(2-morpholin-4-ylphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 9461562
(3R)-1-(2-methoxy-5-methylphenyl)-N-(5-morpholin-4-yl-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 38139612
(3S)-N-(2,6-dimethylphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 9005100
N-(2-hydroxyphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 46665270
(3S)-1-naphthalen-1-yl-5-oxo-N-pyridin-3-ylpyrrolidine-3-carboxamide
CID 26817291
N-methyl-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 47099878
5-oxo-1-(3-propan-2-ylphenyl)-N-(5-pyrrolidin-1-yl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 55587877
(3S)-N-(2-methylphenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 26914330
(3R)-N-(3,4-dichlorophenyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide
CID 9005097
1-(2-ethylphenyl)-N-(5-methyl-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 51265881
1-(naphthalene-1-carbonyl)-N-(5-piperidin-1-yl-2-pyridinyl)piperidine-4-carboxamide
CID 71895394
4-[[(3S)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carbonyl]amino]benzoate
CID 9005113

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide (CID 93276407) is (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide is O=C(Nc1ccc(N2CCOCC2)cn1)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1.
What is the InChIKey of (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide?
The InChIKey is NKRABSTXFJLSIY-GOSISDBHSA-N. The full InChI is InChI=1S/C24H24N4O3/c29-23-14-18(16-28(23)21-7-3-5-17-4-1-2-6-20(17)21)24(30)26-22-9-8-19(15-25-22)27-10-12-31-13-11-27/h1-9,15,18H,10-14,16H2,(H,25,26,30)/t18-/m1/s1.
What are the key properties of (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide?
(3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide has a molecular weight of 416.48 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(5-morpholin-4-yl-2-pyridinyl)-1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 93276407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).