2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide

C11H15N7O — CID 114195265

IUPAC2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide
SMILESCn1cnc(CCNc2cnc(N)cc2C(N)=O)n1
InChIInChI=1S/C11H15N7O/c1-18-6-16-10(17-18)2-3-14-8-5-15-9(12)4-7(8)11(13)19/h4-6,14H,2-3H2,1H3,(H2,12,15)(H2,13,19)
InChIKeyJNMYUPHFVANUKY-UHFFFAOYSA-N
MW261.29 g/mol
LogP-0.45
Rot. Bonds5

About 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide

2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide (PubChem CID 114195265) has the molecular formula C11H15N7O and a molecular weight of 261.29 g/mol. Its IUPAC name is 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide
PubChem CID114195265
Molecular FormulaC11H15N7O
Molecular Weight261.29 g/mol
Exact Mass261.13
IUPAC Name2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide
SMILESCn1cnc(CCNc2cnc(N)cc2C(N)=O)n1
InChIInChI=1S/C11H15N7O/c1-18-6-16-10(17-18)2-3-14-8-5-15-9(12)4-7(8)11(13)19/h4-6,14H,2-3H2,1H3,(H2,12,15)(H2,13,19)
InChIKeyJNMYUPHFVANUKY-UHFFFAOYSA-N
XLogP-0.45
TPSA124.74 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.29
LogP ≤ 5-0.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-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

4-amino-2-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]benzamide
CID 80680908
2-amino-5-[(1-methylpiperidin-4-yl)methylamino]pyridine-4-carboxamide
CID 114195011
ethyl 5-amino-2-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]benzoate
CID 80684480
methyl 3-amino-4-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]benzoate
CID 80686280
2-amino-5-(5-iodo-2-methylanilino)pyridine-4-carboxamide
CID 114257930
5-bromo-2-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]benzoic acid
CID 114895918
2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridine-4-carboxamide
CID 114195291
4-chloro-1-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]benzene-1,2-diamine
CID 80680586
3-amino-3-methyl-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]butanamide
CID 80682439
5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-2-carbothioamide
CID 113320995
3-chloro-4-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]benzoic acid
CID 80686013
methyl 5-amino-3-chloro-2-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]benzoate
CID 107196358

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide (CID 114195265) is 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide is Cn1cnc(CCNc2cnc(N)cc2C(N)=O)n1.
What is the InChIKey of 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide?
The InChIKey is JNMYUPHFVANUKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O/c1-18-6-16-10(17-18)2-3-14-8-5-15-9(12)4-7(8)11(13)19/h4-6,14H,2-3H2,1H3,(H2,12,15)(H2,13,19).
What are the key properties of 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide?
2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide has a molecular weight of 261.29 g/mol, XLogP of -0.45, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[2-(1-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-4-carboxamide is sourced from PubChem (CID 114195265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).