(2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide

C20H24N4O2 — CID 94655019

IUPAC(2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide
SMILESO=C(Nc1cccc(N2CCOCC2)c1)N1CCC[C@@H]1c1ccncc1
InChIInChI=1S/C20H24N4O2/c25-20(24-10-2-5-19(24)16-6-8-21-9-7-16)22-17-3-1-4-18(15-17)23-11-13-26-14-12-23/h1,3-4,6-9,15,19H,2,5,10-14H2,(H,22,25)/t19-/m1/s1
InChIKeyBSGCMKYXOXVCHV-LJQANCHMSA-N
MW352.44 g/mol
LogP3.29
Rot. Bonds3

About (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide

(2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide (PubChem CID 94655019) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide
PubChem CID94655019
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name(2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide
SMILESO=C(Nc1cccc(N2CCOCC2)c1)N1CCC[C@@H]1c1ccncc1
InChIInChI=1S/C20H24N4O2/c25-20(24-10-2-5-19(24)16-6-8-21-9-7-16)22-17-3-1-4-18(15-17)23-11-13-26-14-12-23/h1,3-4,6-9,15,19H,2,5,10-14H2,(H,22,25)/t19-/m1/s1
InChIKeyBSGCMKYXOXVCHV-LJQANCHMSA-N
XLogP3.29
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1,3-dithian-2-yl)phenyl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 71895904
2-(4-methoxyphenyl)-N-pyridin-4-ylpyrrolidine-1-carboxamide
CID 138993640
N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 136576931
N-(3-fluoro-5-morpholin-4-ylphenyl)-2-(1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide
CID 126768067
2-pyridin-4-yl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylpyrrolidine-1-carboxamide
CID 86988125
2-pyridin-4-yl-N-[3-(1,3-thiazol-2-yl)phenyl]azepane-1-carboxamide
CID 87035823
N-[4-(difluoromethylsulfanyl)phenyl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 71941798
(2R)-N-[3-(propan-2-yloxymethyl)phenyl]-2-pyridin-4-ylazepane-1-carboxamide
CID 95235839
2-(4-methoxyphenyl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]azepane-1-carboxamide
CID 51115399
N-(2-phenylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 86987177
N-(1,4-dioxan-2-ylmethyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 71938899
(2S)-N-[4-(morpholin-4-ylmethyl)phenyl]-2-phenylpyrrolidine-1-carboxamide
CID 97437174

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide?
The IUPAC name of (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide (CID 94655019) is (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide?
The canonical SMILES for (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide is O=C(Nc1cccc(N2CCOCC2)c1)N1CCC[C@@H]1c1ccncc1.
What is the InChIKey of (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide?
The InChIKey is BSGCMKYXOXVCHV-LJQANCHMSA-N. The full InChI is InChI=1S/C20H24N4O2/c25-20(24-10-2-5-19(24)16-6-8-21-9-7-16)22-17-3-1-4-18(15-17)23-11-13-26-14-12-23/h1,3-4,6-9,15,19H,2,5,10-14H2,(H,22,25)/t19-/m1/s1.
What are the key properties of (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide?
(2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide has a molecular weight of 352.44 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-morpholin-4-ylphenyl)-2-pyridin-4-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 94655019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).