4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide

C15H17N3OS — CID 81240954

IUPAC4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)N(Cc2ccsc2)C2CC2)cn1
InChIInChI=1S/C15H17N3OS/c1-10-6-14(16)13(7-17-10)15(19)18(12-2-3-12)8-11-4-5-20-9-11/h4-7,9,12H,2-3,8H2,1H3,(H2,16,17)
InChIKeyMYOCKANQSOJPGC-UHFFFAOYSA-N
MW287.39 g/mol
LogP2.84
Rot. Bonds4

About 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide

4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 81240954) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
PubChem CID81240954
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC Name4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)N(Cc2ccsc2)C2CC2)cn1
InChIInChI=1S/C15H17N3OS/c1-10-6-14(16)13(7-17-10)15(19)18(12-2-3-12)8-11-4-5-20-9-11/h4-7,9,12H,2-3,8H2,1H3,(H2,16,17)
InChIKeyMYOCKANQSOJPGC-UHFFFAOYSA-N
XLogP2.84
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-cyclopropyl-5-methyl-N-(thiophen-3-ylmethyl)benzamide
CID 62508692
2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)benzamide
CID 55138412
N-cyclopropyl-2,5-dimethyl-N-(thiophen-3-ylmethyl)benzamide
CID 51055390
4-amino-N-cyclopropyl-6-methyl-N-(3-methylbutyl)pyridine-3-carboxamide
CID 81239834
N-cyclopropyl-4-hydrazinyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 81255572
2-N-cyclopropyl-4-methyl-2-N-(thiophen-3-ylmethyl)pyridine-2,5-diamine
CID 79173041
N-cyclopropyl-N-(thiophen-3-ylmethyl)-1,3-benzothiazole-6-carboxamide
CID 72717897
N-cyclopropyl-2-(dimethylamino)-N-(thiophen-3-ylmethyl)pyridine-4-carboxamide
CID 51095237
4-amino-N-cyclopropyl-1-ethyl-N-(thiophen-3-ylmethyl)pyrrole-2-carboxamide
CID 61433686
N-cyclopropyl-N-(thiophen-3-ylmethyl)carbamoyl chloride
CID 79887165
2-amino-N-cyclopropyl-N-(thiophen-3-ylmethyl)propanamide
CID 61166609
4-amino-N-cyclopropyl-1-propyl-N-(thiophen-3-ylmethyl)pyrrole-2-carboxamide
CID 61433687

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide (CID 81240954) is 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide is Cc1cc(N)c(C(=O)N(Cc2ccsc2)C2CC2)cn1.
What is the InChIKey of 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is MYOCKANQSOJPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c1-10-6-14(16)13(7-17-10)15(19)18(12-2-3-12)8-11-4-5-20-9-11/h4-7,9,12H,2-3,8H2,1H3,(H2,16,17).
What are the key properties of 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide?
4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 287.39 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-6-methyl-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81240954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).