1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide

C15H17N3OS — CID 178138908

IUPAC1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide
SMILESC=C1CCC(C(=O)NCc2cc3cnccc3s2)N1C
InChIInChI=1S/C15H17N3OS/c1-10-3-4-13(18(10)2)15(19)17-9-12-7-11-8-16-6-5-14(11)20-12/h5-8,13H,1,3-4,9H2,2H3,(H,17,19)
InChIKeyRPBCINNPWJKCAT-UHFFFAOYSA-N
MW287.39 g/mol
LogP2.52
Rot. Bonds3

About 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide

1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide (PubChem CID 178138908) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide
PubChem CID178138908
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC Name1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide
SMILESC=C1CCC(C(=O)NCc2cc3cnccc3s2)N1C
InChIInChI=1S/C15H17N3OS/c1-10-3-4-13(18(10)2)15(19)17-9-12-7-11-8-16-6-5-14(11)20-12/h5-8,13H,1,3-4,9H2,2H3,(H,17,19)
InChIKeyRPBCINNPWJKCAT-UHFFFAOYSA-N
XLogP2.52
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)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

benzene;3-(cyclopropylmethylamino)-4-oxo-N-(thieno[3,2-c]pyridin-2-ylmethyl)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidine-6-carboxamide
CID 178137749
(6S)-4-oxo-3-(3-phenylpropylamino)-N-(thieno[3,2-c]pyridin-2-ylmethyl)-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidine-6-carboxamide
CID 178138265
N-methyl-1-thieno[3,2-c]pyridin-2-ylmethanamine
CID 45117642
1-methyl-5-methylidene-N-(1H-pyrrolo[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide;(E)-2-[(2-phenyl-1H-imidazol-5-yl)methylamino]but-2-enal;propane
CID 178137632
1-methyl-5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
CID 110687261
N-[(6-aminothieno[3,2-c]pyridin-2-yl)methyl]-5-[(E)-2-formamido-3-oxoprop-1-enyl]imino-1-methylpyrrolidine-2-carboxamide
CID 178138319
(2S)-N-(1-benzothiophen-2-ylmethyl)-1-piperidin-4-ylpyrrolidine-2-carboxamide
CID 118795564
(2S)-4-[(4S,5S)-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-1-[(2R)-6-piperidin-1-yl-2-(propan-2-ylamino)hexanoyl]-N-(thieno[3,2-c]pyridin-2-ylmethyl)piperazine-2-carboxamide
CID 146257326
[2-[[6-[(6-aminothieno[3,2-c]pyridin-2-yl)methylcarbamoyl]-4-oxo-7,8-dihydro-6H-pyrrolo[1,2-a]pyrimidin-3-yl]amino]-2-oxoethanimidoyl] pyridine-4-carboximidothioate
CID 178138652
1-methyl-5-oxo-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide
CID 110687259
N-[(5-fluoro-1-benzothiophen-2-yl)methyl]-2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide
CID 138027813
(2S)-N-(2-hydroxyethyl)-1-(thieno[2,3-c]pyridine-2-carbonyl)pyrrolidine-2-carboxamide
CID 167811053

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide (CID 178138908) is 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide is C=C1CCC(C(=O)NCc2cc3cnccc3s2)N1C.
What is the InChIKey of 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide?
The InChIKey is RPBCINNPWJKCAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c1-10-3-4-13(18(10)2)15(19)17-9-12-7-11-8-16-6-5-14(11)20-12/h5-8,13H,1,3-4,9H2,2H3,(H,17,19).
What are the key properties of 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide?
1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide has a molecular weight of 287.39 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-methylidene-N-(thieno[3,2-c]pyridin-2-ylmethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 178138908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).