N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine

C12H13N7 — CID 104599717

IUPACN-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine
SMILESCn1nncc1CNc1cccnc1-n1cccn1
InChIInChI=1S/C12H13N7/c1-18-10(9-15-17-18)8-14-11-4-2-5-13-12(11)19-7-3-6-16-19/h2-7,9,14H,8H2,1H3
InChIKeyDLGJEIYLAJJFGM-UHFFFAOYSA-N
MW255.29 g/mol
LogP1.01
Rot. Bonds4

About N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine

N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine (PubChem CID 104599717) has the molecular formula C12H13N7 and a molecular weight of 255.29 g/mol. Its IUPAC name is N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine
PubChem CID104599717
Molecular FormulaC12H13N7
Molecular Weight255.29 g/mol
Exact Mass255.12
IUPAC NameN-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine
SMILESCn1nncc1CNc1cccnc1-n1cccn1
InChIInChI=1S/C12H13N7/c1-18-10(9-15-17-18)8-14-11-4-2-5-13-12(11)19-7-3-6-16-19/h2-7,9,14H,8H2,1H3
InChIKeyDLGJEIYLAJJFGM-UHFFFAOYSA-N
XLogP1.01
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[(2-ethylpyrazol-3-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine
CID 75505630
8-methyl-N-[(3-methyltriazol-4-yl)methyl]quinolin-5-amine
CID 115743584
N-pentyl-2-pyrazol-1-ylpyridin-3-amine
CID 43736889
N-[(4,5-dibromofuran-2-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine
CID 62085914
N-[(3-methyltriazol-4-yl)methyl]-1-(2-pyrazol-1-ylphenyl)methanamine
CID 115682527
4-[[(2-pyrazol-1-yl-3-pyridinyl)amino]methyl]benzene-1,3-diol
CID 43736967
N-[(3-bromofuran-2-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine
CID 106885249
2-pyrazol-1-yl-N-[(2,3,4-trimethoxyphenyl)methyl]pyridin-3-amine
CID 75415259
2-methylsulfonyl-N-[(3-methyltriazol-4-yl)methyl]aniline
CID 113483013
N-[(3-methyltriazol-4-yl)methyl]-2-propoxyaniline
CID 115682687
4-fluoro-2-[[(2-pyrazol-1-yl-3-pyridinyl)amino]methyl]phenol
CID 107694361
3-[2-[(3-methyltriazol-4-yl)methylamino]phenoxy]propanamide
CID 115744008

Frequently Asked Questions

What is the IUPAC name of N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine?
The IUPAC name of N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine (CID 104599717) is N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine.
What is the SMILES notation for N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine?
The canonical SMILES for N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine is Cn1nncc1CNc1cccnc1-n1cccn1.
What is the InChIKey of N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine?
The InChIKey is DLGJEIYLAJJFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N7/c1-18-10(9-15-17-18)8-14-11-4-2-5-13-12(11)19-7-3-6-16-19/h2-7,9,14H,8H2,1H3.
What are the key properties of N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine?
N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine has a molecular weight of 255.29 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyltriazol-4-yl)methyl]-2-pyrazol-1-ylpyridin-3-amine is sourced from PubChem (CID 104599717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).