N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide

C17H22N4O2S — CID 154780813

IUPACN-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide
SMILESCOc1ccc(C)nc1NC(=O)N1CCC(Cc2nc(C)cs2)C1
InChIInChI=1S/C17H22N4O2S/c1-11-4-5-14(23-3)16(19-11)20-17(22)21-7-6-13(9-21)8-15-18-12(2)10-24-15/h4-5,10,13H,6-9H2,1-3H3,(H,19,20,22)
InChIKeyADXUXUBMBPDXFL-UHFFFAOYSA-N
MW346.46 g/mol
LogP3.26
Rot. Bonds4

About N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide

N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide (PubChem CID 154780813) has the molecular formula C17H22N4O2S and a molecular weight of 346.46 g/mol. Its IUPAC name is N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide
PubChem CID154780813
Molecular FormulaC17H22N4O2S
Molecular Weight346.46 g/mol
Exact Mass346.15
IUPAC NameN-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide
SMILESCOc1ccc(C)nc1NC(=O)N1CCC(Cc2nc(C)cs2)C1
InChIInChI=1S/C17H22N4O2S/c1-11-4-5-14(23-3)16(19-11)20-17(22)21-7-6-13(9-21)8-15-18-12(2)10-24-15/h4-5,10,13H,6-9H2,1-3H3,(H,19,20,22)
InChIKeyADXUXUBMBPDXFL-UHFFFAOYSA-N
XLogP3.26
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.46
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide with MolForge

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Related Compounds

N-[2-(methoxymethyl)pyrimidin-4-yl]-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide
CID 138025739
1-[(3-methoxy-6-methyl-2-pyridinyl)carbamoyl]piperidine-4-carboxylic acid
CID 122090037
N-(3-methoxy-6-methyl-2-pyridinyl)-7-oxa-2-azaspiro[3.5]nonane-2-carboxamide
CID 128621329
(3S,4S)-1-[(3-methoxy-6-methyl-2-pyridinyl)carbamoyl]-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 122090034
5-[(3R)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carbonyl]-3H-1,3-benzoxazol-2-one
CID 164643198
4-benzyl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide
CID 86986848
N-(3-methoxy-6-methyl-2-pyridinyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine-7-carboxamide
CID 127901681
1-[3-[(4-methyl-1,3-thiazol-2-yl)methyl]piperidin-1-yl]-2-(1,2-thiazol-3-yloxy)ethanone
CID 166269421
(3S)-N-(4-methoxy-3-methylphenyl)-3-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-1-carboxamide
CID 97003801
N-(4-methoxy-3-methylphenyl)-3-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-1-carboxamide
CID 71865837
4-N-(2-methoxyphenyl)-1-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1,4-dicarboxamide
CID 86986741
3-(aminomethyl)-N-[2-[(3,4-dimethoxyphenyl)methyl]-5-methylpyrazol-3-yl]pyrrolidine-1-carboxamide
CID 118787317

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide (CID 154780813) is N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide is COc1ccc(C)nc1NC(=O)N1CCC(Cc2nc(C)cs2)C1.
What is the InChIKey of N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide?
The InChIKey is ADXUXUBMBPDXFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2S/c1-11-4-5-14(23-3)16(19-11)20-17(22)21-7-6-13(9-21)8-15-18-12(2)10-24-15/h4-5,10,13H,6-9H2,1-3H3,(H,19,20,22).
What are the key properties of N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide?
N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide has a molecular weight of 346.46 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-6-methyl-2-pyridinyl)-3-[(4-methyl-1,3-thiazol-2-yl)methyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 154780813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).