5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide

C14H18N4OS — CID 61453095

IUPAC5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide
SMILESCC(C)N(Cc1cccs1)c1ncc(N)cc1C(N)=O
InChIInChI=1S/C14H18N4OS/c1-9(2)18(8-11-4-3-5-20-11)14-12(13(16)19)6-10(15)7-17-14/h3-7,9H,8,15H2,1-2H3,(H2,16,19)
InChIKeyOVMBMHCWKOTSQG-UHFFFAOYSA-N
MW290.39 g/mol
LogP2.24
Rot. Bonds5

About 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide

5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide (PubChem CID 61453095) has the molecular formula C14H18N4OS and a molecular weight of 290.39 g/mol. Its IUPAC name is 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide
PubChem CID61453095
Molecular FormulaC14H18N4OS
Molecular Weight290.39 g/mol
Exact Mass290.12
IUPAC Name5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide
SMILESCC(C)N(Cc1cccs1)c1ncc(N)cc1C(N)=O
InChIInChI=1S/C14H18N4OS/c1-9(2)18(8-11-4-3-5-20-11)14-12(13(16)19)6-10(15)7-17-14/h3-7,9H,8,15H2,1-2H3,(H2,16,19)
InChIKeyOVMBMHCWKOTSQG-UHFFFAOYSA-N
XLogP2.24
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carbothioamide
CID 61452711
2-N-propan-2-yl-2-N-(thiophen-2-ylmethyl)pyrimidine-2,5-diamine
CID 54946553
5-bromo-2-N-propan-2-yl-2-N-(thiophen-2-ylmethyl)pyridine-2,3-diamine
CID 54946602
5-amino-2-[propan-2-yl(2,2,2-trifluoroethyl)amino]pyridine-3-carboxamide
CID 55011059
5-N-propan-2-yl-5-N-(thiophen-2-ylmethyl)pyridine-3,5-diamine
CID 104533407
5-amino-2-[2-methoxyethyl(propan-2-yl)amino]pyridine-3-carboxamide
CID 82948360
3-bromo-5-methyl-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 105367794
3-[propan-2-yl(thiophen-2-ylmethyl)amino]pyrazine-2-carbothioamide
CID 62684451
5-fluoro-4-N-propan-2-yl-4-N-(thiophen-2-ylmethyl)pyrimidine-2,4-diamine
CID 80808330
5-amino-2-(thiophen-2-ylmethoxy)pyridine-3-carboxamide
CID 54966607
4-N-propan-2-yl-4-N-(thiophen-2-ylmethyl)pyrimidine-4,5-diamine
CID 79917686
3-(aminomethyl)-5-bromo-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 55055076

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide?
The IUPAC name of 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide (CID 61453095) is 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide.
What is the SMILES notation for 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide?
The canonical SMILES for 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide is CC(C)N(Cc1cccs1)c1ncc(N)cc1C(N)=O.
What is the InChIKey of 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide?
The InChIKey is OVMBMHCWKOTSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4OS/c1-9(2)18(8-11-4-3-5-20-11)14-12(13(16)19)6-10(15)7-17-14/h3-7,9H,8,15H2,1-2H3,(H2,16,19).
What are the key properties of 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide?
5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide has a molecular weight of 290.39 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-[propan-2-yl(thiophen-2-ylmethyl)amino]pyridine-3-carboxamide is sourced from PubChem (CID 61453095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).