6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide

C14H17N3OS — CID 62239163

IUPAC6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide
SMILESCc1cc(C(C)NC(=O)c2cccc(N)n2)c(C)s1
InChIInChI=1S/C14H17N3OS/c1-8-7-11(10(3)19-8)9(2)16-14(18)12-5-4-6-13(15)17-12/h4-7,9H,1-3H3,(H2,15,17)(H,16,18)
InChIKeyBOZGFAICHOEINT-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.83
Rot. Bonds3

About 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide

6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide (PubChem CID 62239163) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide
PubChem CID62239163
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide
SMILESCc1cc(C(C)NC(=O)c2cccc(N)n2)c(C)s1
InChIInChI=1S/C14H17N3OS/c1-8-7-11(10(3)19-8)9(2)16-14(18)12-5-4-6-13(15)17-12/h4-7,9H,1-3H3,(H2,15,17)(H,16,18)
InChIKeyBOZGFAICHOEINT-UHFFFAOYSA-N
XLogP2.83
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-3-carboxamide
CID 62073045
2-(1-aminoethyl)-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 66390401
3-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide
CID 104741138
6-amino-N-[1-(5-methyl-1H-imidazol-2-yl)ethyl]pyridine-2-carboxamide
CID 122572343
3-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-4-methylbenzamide
CID 43696642
6-amino-N-(1-thiophen-3-ylethyl)pyridine-2-carboxamide
CID 62844800
1,3-bis[1-(2,5-dimethylthiophen-3-yl)ethyl]urea
CID 71897547
4-(aminomethyl)-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]benzamide;hydrochloride
CID 119287416
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-1H-pyrazole-4-carboxamide
CID 60967175
6-amino-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]pyridine-2-carboxamide
CID 79238480
3-chloro-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-6-hydrazinylpyridine-2-carboxamide
CID 62247454
2-[3-[1-(2,5-dimethylthiophen-3-yl)ethylcarbamoyl]phenyl]acetic acid
CID 146130625

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide (CID 62239163) is 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide is Cc1cc(C(C)NC(=O)c2cccc(N)n2)c(C)s1.
What is the InChIKey of 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is BOZGFAICHOEINT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-8-7-11(10(3)19-8)9(2)16-14(18)12-5-4-6-13(15)17-12/h4-7,9H,1-3H3,(H2,15,17)(H,16,18).
What are the key properties of 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide?
6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 275.38 g/mol, XLogP of 2.83, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[1-(2,5-dimethylthiophen-3-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 62239163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).