2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine

C14H20N6 — CID 136562665

IUPAC2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine
SMILESCc1cncc(CN2CCCC2c2nc(N)n(C)n2)c1
InChIInChI=1S/C14H20N6/c1-10-6-11(8-16-7-10)9-20-5-3-4-12(20)13-17-14(15)19(2)18-13/h6-8,12H,3-5,9H2,1-2H3,(H2,15,17,18)
InChIKeyFHQFDVPKZQPFNQ-UHFFFAOYSA-N
MW272.36 g/mol
LogP1.44
Rot. Bonds3

About 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine

2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine (PubChem CID 136562665) has the molecular formula C14H20N6 and a molecular weight of 272.36 g/mol. Its IUPAC name is 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine
PubChem CID136562665
Molecular FormulaC14H20N6
Molecular Weight272.36 g/mol
Exact Mass272.17
IUPAC Name2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine
SMILESCc1cncc(CN2CCCC2c2nc(N)n(C)n2)c1
InChIInChI=1S/C14H20N6/c1-10-6-11(8-16-7-10)9-20-5-3-4-12(20)13-17-14(15)19(2)18-13/h6-8,12H,3-5,9H2,1-2H3,(H2,15,17,18)
InChIKeyFHQFDVPKZQPFNQ-UHFFFAOYSA-N
XLogP1.44
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.36
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine with MolForge

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Related Compounds

3-methyl-5-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]pyridine
CID 146126331
3-[[2-(3-chloropropyl)pyrrolidin-1-yl]methyl]-5-methylpyridine
CID 102878849
N-[[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]methyl]propan-1-amine
CID 102881483
5-[1-(6,7-difluoroquinoxalin-2-yl)pyrrolidin-2-yl]-2-methyl-1,2,4-triazol-3-amine
CID 122154124
(1S)-1-(1-methylpyrazol-4-yl)-2-[(2R)-1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]ethanol
CID 124734701
ethane;1-methyl-4-[(5-methyl-3-pyridinyl)methyl]piperazine
CID 143962339
2-[2-(5-amino-1-methyl-1,2,4-triazol-3-yl)pyrrolidin-1-yl]-N-(3-methoxyphenyl)acetamide
CID 119040618
2-methyl-N-[[1-[(5-methyl-3-pyridinyl)methyl]piperidin-2-yl]methyl]propan-2-amine
CID 102879282
3-[[3-(2-chloroethyl)piperidin-1-yl]methyl]-5-methylpyridine
CID 102878847
3-[[3-(chloromethyl)piperidin-1-yl]methyl]-5-methylpyridine
CID 102878825
1-[(5-methyl-3-pyridinyl)methyl]-1,2,4-triazol-3-amine
CID 102881131
[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-3-yl]methanamine
CID 103840862

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine?
The IUPAC name of 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine (CID 136562665) is 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine.
What is the SMILES notation for 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine?
The canonical SMILES for 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine is Cc1cncc(CN2CCCC2c2nc(N)n(C)n2)c1.
What is the InChIKey of 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine?
The InChIKey is FHQFDVPKZQPFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6/c1-10-6-11(8-16-7-10)9-20-5-3-4-12(20)13-17-14(15)19(2)18-13/h6-8,12H,3-5,9H2,1-2H3,(H2,15,17,18).
What are the key properties of 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine?
2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine has a molecular weight of 272.36 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[1-[(5-methyl-3-pyridinyl)methyl]pyrrolidin-2-yl]-1,2,4-triazol-3-amine is sourced from PubChem (CID 136562665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).