N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine

C10H15N5 — CID 141239647

IUPACN,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine
SMILESCNc1nnc(C2=CCN(C)C=C2)n1C
InChIInChI=1S/C10H15N5/c1-11-10-13-12-9(15(10)3)8-4-6-14(2)7-5-8/h4-6H,7H2,1-3H3,(H,11,13)
InChIKeyKABQNHSFNDMNJV-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.70
Rot. Bonds2

About N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine

N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine (PubChem CID 141239647) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine.

Molecular Properties

Compound NameN,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine
PubChem CID141239647
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC NameN,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine
SMILESCNc1nnc(C2=CCN(C)C=C2)n1C
InChIInChI=1S/C10H15N5/c1-11-10-13-12-9(15(10)3)8-4-6-14(2)7-5-8/h4-6H,7H2,1-3H3,(H,11,13)
InChIKeyKABQNHSFNDMNJV-UHFFFAOYSA-N
XLogP0.70
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[5-(Ethylamino)-4-methyl-1,2,4-triazol-3-yl]-1-methylpyridin-2-one
CID 57672186
1-Methyl-4-[4-methyl-5-(methylamino)-1,2,4-triazol-3-yl]pyridin-2-one
CID 57672190
N-methyl-5-[(3E)-penta-1,3-dien-3-yl]-1H-1,2,4-triazol-3-amine
CID 123450996
5-[(2E,4Z)-hexa-2,4-dien-2-yl]-1-methyl-N-propyl-1,2,4-triazol-3-amine
CID 137468650
1-methyl-4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)-2H-pyridine
CID 141204988
3,4-dimethyl-5-[(E,1Z)-1-(2-methyl-1,2-dihydropyrrol-3-ylidene)but-2-en-2-yl]-1,2,4-triazole
CID 142140854
3-(4,5-dimethyl-1,2,4-triazol-3-yl)-1H-pyridine-2-thione
CID 174648441
4-(5-ethyl-4-methyl-1,2,4-triazol-3-yl)-1H-pyridine-2-thione
CID 174650832
4-[4-methyl-5-(methylamino)-1,2,4-triazol-3-yl]-1H-pyridin-2-one
CID 108104867
4-[4-ethyl-5-(ethylamino)-1,2,4-triazol-3-yl]-1H-pyridin-2-one
CID 108104868
4-(5-amino-1-methyl-1,2,4-triazol-3-yl)-1H-pyridin-2-one
CID 108104871
4-(5-Amino-1-methyl-1,2,4-triazol-3-yl)-1-methylpyridin-2-one
CID 108104872

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine?
The IUPAC name of N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine (CID 141239647) is N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine.
What is the SMILES notation for N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine?
The canonical SMILES for N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine is CNc1nnc(C2=CCN(C)C=C2)n1C.
What is the InChIKey of N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine?
The InChIKey is KABQNHSFNDMNJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-11-10-13-12-9(15(10)3)8-4-6-14(2)7-5-8/h4-6H,7H2,1-3H3,(H,11,13).
What are the key properties of N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine?
N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine has a molecular weight of 205.26 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-5-(1-methyl-2H-pyridin-4-yl)-1,2,4-triazol-3-amine is sourced from PubChem (CID 141239647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).