(2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide

C14H15N3OS — CID 99777125

IUPAC(2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide
SMILESO=C(Nc1cnc(-c2ccccc2)s1)[C@H]1CCCN1
InChIInChI=1S/C14H15N3OS/c18-13(11-7-4-8-15-11)17-12-9-16-14(19-12)10-5-2-1-3-6-10/h1-3,5-6,9,11,15H,4,7-8H2,(H,17,18)/t11-/m1/s1
InChIKeyOFARXCCNMHUGRF-LLVKDONJSA-N
MW273.36 g/mol
LogP2.50
Rot. Bonds3

About (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide

(2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide (PubChem CID 99777125) has the molecular formula C14H15N3OS and a molecular weight of 273.36 g/mol. Its IUPAC name is (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide
PubChem CID99777125
Molecular FormulaC14H15N3OS
Molecular Weight273.36 g/mol
Exact Mass273.09
IUPAC Name(2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide
SMILESO=C(Nc1cnc(-c2ccccc2)s1)[C@H]1CCCN1
InChIInChI=1S/C14H15N3OS/c18-13(11-7-4-8-15-11)17-12-9-16-14(19-12)10-5-2-1-3-6-10/h1-3,5-6,9,11,15H,4,7-8H2,(H,17,18)/t11-/m1/s1
InChIKeyOFARXCCNMHUGRF-LLVKDONJSA-N
XLogP2.50
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[5-[3-(2-phenyl-1,3-thiazol-5-yl)azetidine-1-carbonyl]thiophen-2-yl]pyrrolidine-2-carboxamide
CID 162698088
N-(5-phenyl-1,3-thiazol-2-yl)piperidine-2-carboxamide
CID 119287690
N-(2-phenyl-4-pyridinyl)pyrrolidine-2-carboxamide
CID 119877635
N-(2-phenylphenyl)pyrrolidine-2-carboxamide
CID 18072250
(2R)-N-(3,5-diphenylphenyl)pyrrolidine-2-carboxamide
CID 121274963
N-thiophen-2-ylpyrrolidine-2-carboxamide
CID 115159164
(2S)-N-(6-anilino-3-pyridinyl)pyrrolidine-2-carboxamide;hydrochloride
CID 122081463
(2R)-N-pyridin-2-ylpyrrolidine-2-carboxamide
CID 103813190
N-(6-phenoxy-3-pyridinyl)pyrrolidine-2-carboxamide
CID 119849166
2-[2-(pyrrolidine-2-carbonylamino)phenyl]acetic acid
CID 62534786
N-(2-phenylphenyl)piperidine-2-carboxamide
CID 18072559
(2S)-N-pyridin-3-ylpyrrolidine-2-carboxamide
CID 10607737

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide (CID 99777125) is (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide is O=C(Nc1cnc(-c2ccccc2)s1)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide?
The InChIKey is OFARXCCNMHUGRF-LLVKDONJSA-N. The full InChI is InChI=1S/C14H15N3OS/c18-13(11-7-4-8-15-11)17-12-9-16-14(19-12)10-5-2-1-3-6-10/h1-3,5-6,9,11,15H,4,7-8H2,(H,17,18)/t11-/m1/s1.
What are the key properties of (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide?
(2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide has a molecular weight of 273.36 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-phenyl-1,3-thiazol-5-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 99777125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).