(2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide

C11H14FN3O — CID 126623254

IUPAC(2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide
SMILESCc1cc(NC(=O)[C@@H]2C[C@@H](F)CN2)ccn1
InChIInChI=1S/C11H14FN3O/c1-7-4-9(2-3-13-7)15-11(16)10-5-8(12)6-14-10/h2-4,8,10,14H,5-6H2,1H3,(H,13,15,16)/t8-,10+/m1/s1
InChIKeyYELRVGHCMSRDAH-SCZZXKLOSA-N
MW223.25 g/mol
LogP1.03
Rot. Bonds2

About (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide

(2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide (PubChem CID 126623254) has the molecular formula C11H14FN3O and a molecular weight of 223.25 g/mol. Its IUPAC name is (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide
PubChem CID126623254
Molecular FormulaC11H14FN3O
Molecular Weight223.25 g/mol
Exact Mass223.11
IUPAC Name(2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide
SMILESCc1cc(NC(=O)[C@@H]2C[C@@H](F)CN2)ccn1
InChIInChI=1S/C11H14FN3O/c1-7-4-9(2-3-13-7)15-11(16)10-5-8(12)6-14-10/h2-4,8,10,14H,5-6H2,1H3,(H,13,15,16)/t8-,10+/m1/s1
InChIKeyYELRVGHCMSRDAH-SCZZXKLOSA-N
XLogP1.03
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-methyl-4-pyridinyl)-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119832878
(2R,4S)-4-fluoro-N-(1H-pyrazol-5-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 130774690
N-(2-methyl-4-pyridinyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
CID 79240195
(2S,4R)-4-fluoro-N-(1,2,4-thiadiazol-5-yl)pyrrolidine-2-carboxamide
CID 59436422
4,5-dimethyl-N-(2-methyl-4-pyridinyl)oxolane-2-carboxamide
CID 171794687
(2R,4S)-4-fluoro-N-(1H-1,2,4-triazol-5-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 130653783
6-[[(2S,4R)-4-fluoropyrrolidine-2-carbonyl]amino]naphthalene-1-sulfonic acid;hydrochloride
CID 126623819
1-[(2-methyl-4-pyridinyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 79240228
2-amino-N-(2-methyl-4-pyridinyl)cyclopentane-1-carboxamide
CID 79240939
3-amino-N-(2-methyl-4-pyridinyl)bicyclo[2.2.1]heptane-2-carboxamide;dihydrochloride
CID 119832843
N-(6-cyclopropyl-2-pyridinyl)-4-fluoropyrrolidine-2-carboxamide
CID 175776752
cis-(1R,2S)-N-(2-methyl-4-pyridinyl)-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 96526962

Frequently Asked Questions

What is the IUPAC name of (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide (CID 126623254) is (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide is Cc1cc(NC(=O)[C@@H]2C[C@@H](F)CN2)ccn1.
What is the InChIKey of (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide?
The InChIKey is YELRVGHCMSRDAH-SCZZXKLOSA-N. The full InChI is InChI=1S/C11H14FN3O/c1-7-4-9(2-3-13-7)15-11(16)10-5-8(12)6-14-10/h2-4,8,10,14H,5-6H2,1H3,(H,13,15,16)/t8-,10+/m1/s1.
What are the key properties of (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide?
(2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide has a molecular weight of 223.25 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4R)-4-fluoro-N-(2-methyl-4-pyridinyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 126623254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).