2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide

C14H17N3OS — CID 106015823

IUPAC2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide
SMILESCCc1ccc(CNC(=O)c2cc(C)nc(N)c2)s1
InChIInChI=1S/C14H17N3OS/c1-3-11-4-5-12(19-11)8-16-14(18)10-6-9(2)17-13(15)7-10/h4-7H,3,8H2,1-2H3,(H2,15,17)(H,16,18)
InChIKeyASRLKNVPUATOFK-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.53
Rot. Bonds4

About 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide

2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide (PubChem CID 106015823) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide
PubChem CID106015823
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide
SMILESCCc1ccc(CNC(=O)c2cc(C)nc(N)c2)s1
InChIInChI=1S/C14H17N3OS/c1-3-11-4-5-12(19-11)8-16-14(18)10-6-9(2)17-13(15)7-10/h4-7H,3,8H2,1-2H3,(H2,15,17)(H,16,18)
InChIKeyASRLKNVPUATOFK-UHFFFAOYSA-N
XLogP2.53
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-3-bromo-N-[(5-ethylthiophen-2-yl)methyl]benzamide
CID 106011768
2-amino-6-methyl-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-carboxamide
CID 102908018
N-[(5-ethylthiophen-2-yl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 113257144
2-amino-6-methyl-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 113378967
N-[(5-ethylthiophen-2-yl)methyl]-6-oxo-1H-pyridine-3-carboxamide
CID 46475867
N-[(5-ethylthiophen-2-yl)methyl]-2H-tetrazole-5-carboxamide
CID 106011879
2,6-dichloro-N-[(5-methylthiophen-2-yl)methyl]pyridine-4-carboxamide
CID 55021338
2-amino-6-methyl-N-[(1-propylcyclopropyl)methyl]pyridine-4-carboxamide
CID 114101909
3,5-dibromo-N-[(5-methylthiophen-2-yl)methyl]benzamide
CID 107980409
4-amino-3,5-dichloro-N-[(5-methylthiophen-2-yl)methyl]benzamide
CID 82832866
N-[(5-ethylthiophen-2-yl)methyl]-2,6-dihydroxybenzamide
CID 103749033
5-ethyl-N-[(5-ethylthiophen-2-yl)methyl]-1H-pyrazole-3-carboxamide
CID 78876589

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide?
The IUPAC name of 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide (CID 106015823) is 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide is CCc1ccc(CNC(=O)c2cc(C)nc(N)c2)s1.
What is the InChIKey of 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide?
The InChIKey is ASRLKNVPUATOFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-3-11-4-5-12(19-11)8-16-14(18)10-6-9(2)17-13(15)7-10/h4-7H,3,8H2,1-2H3,(H2,15,17)(H,16,18).
What are the key properties of 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide?
2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide has a molecular weight of 275.38 g/mol, XLogP of 2.53, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(5-ethylthiophen-2-yl)methyl]-6-methylpyridine-4-carboxamide is sourced from PubChem (CID 106015823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).