N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine

C9H9N5 — CID 123270108

IUPACN-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
SMILESc1ccc(CNc2ncncn2)nc1
InChIInChI=1S/C9H9N5/c1-2-4-11-8(3-1)5-12-9-13-6-10-7-14-9/h1-4,6-7H,5H2,(H,10,12,13,14)
InChIKeyUHXNGELYUNJESA-UHFFFAOYSA-N
MW187.21 g/mol
LogP0.88
Rot. Bonds3

About N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine

N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine (PubChem CID 123270108) has the molecular formula C9H9N5 and a molecular weight of 187.21 g/mol. Its IUPAC name is N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
PubChem CID123270108
Molecular FormulaC9H9N5
Molecular Weight187.21 g/mol
Exact Mass187.09
IUPAC NameN-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
SMILESc1ccc(CNc2ncncn2)nc1
InChIInChI=1S/C9H9N5/c1-2-4-11-8(3-1)5-12-9-13-6-10-7-14-9/h1-4,6-7H,5H2,(H,10,12,13,14)
InChIKeyUHXNGELYUNJESA-UHFFFAOYSA-N
XLogP0.88
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.21
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-fluoro-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
CID 115749808
2-N-(pyridin-2-ylmethyl)pyrimidine-2,5-diamine
CID 61146429
2-N,4-N-diphenyl-6-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine
CID 67212949
zinc;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;dihydrochloride
CID 73345757
4-(4-phenylphenyl)-N-(pyridin-2-ylmethyl)aniline
CID 101246794
N'-(pyridin-2-ylmethyl)-N-[2-(pyridin-2-ylmethylamino)ethyl]ethane-1,2-diamine
CID 12029921
4-methyl-N-(pyridin-2-ylmethyl)pyridin-3-amine
CID 63329318
3-fluoro-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 62733415
5-iodo-6-methyl-2-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 171984806
5-methyl-2-N,4-N-bis(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 71922543
N-(pyridin-2-ylmethyl)-1-[6-[(pyridin-2-ylmethylamino)methyl]-2-pyridinyl]methanamine
CID 564837
N-(pyridin-2-ylmethyl)-1H-pyrrol-3-amine
CID 69193453

Frequently Asked Questions

What is the IUPAC name of N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine?
The IUPAC name of N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine (CID 123270108) is N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine is c1ccc(CNc2ncncn2)nc1.
What is the InChIKey of N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine?
The InChIKey is UHXNGELYUNJESA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5/c1-2-4-11-8(3-1)5-12-9-13-6-10-7-14-9/h1-4,6-7H,5H2,(H,10,12,13,14).
What are the key properties of N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine?
N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine has a molecular weight of 187.21 g/mol, XLogP of 0.88, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 123270108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).