6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine

C10H17N5 — CID 79826028

IUPAC6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine
SMILESCN1CCC(Nc2ccc(N)c(N)n2)C1
InChIInChI=1S/C10H17N5/c1-15-5-4-7(6-15)13-9-3-2-8(11)10(12)14-9/h2-3,7H,4-6,11H2,1H3,(H3,12,13,14)
InChIKeyQZMMHKNEZBKIHO-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.36
Rot. Bonds2

About 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine

6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine (PubChem CID 79826028) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine.

Molecular Properties

Compound Name6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine
PubChem CID79826028
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine
SMILESCN1CCC(Nc2ccc(N)c(N)n2)C1
InChIInChI=1S/C10H17N5/c1-15-5-4-7(6-15)13-9-3-2-8(11)10(12)14-9/h2-3,7H,4-6,11H2,1H3,(H3,12,13,14)
InChIKeyQZMMHKNEZBKIHO-UHFFFAOYSA-N
XLogP0.36
TPSA80.20 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile
CID 103467847
6-N-cyclohexylpyridine-2,3,6-triamine
CID 79823249
6-tert-butyl-4-N-(1-methylpyrrolidin-3-yl)pyrimidine-2,4-diamine
CID 66740280
4-[(5,6-diamino-2-pyridinyl)amino]cyclohexan-1-ol
CID 79822536
5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine
CID 83266421
5-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carboxamide
CID 114405789
2-chloro-6-methyl-N-(1-methylpyrrolidin-3-yl)pyrimidin-4-amine
CID 62481987
4-bromo-2-N-(1-methylpyrrolidin-3-yl)benzene-1,2-diamine
CID 65343279
2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine
CID 114503076
methyl 5-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carboxylate
CID 114405790
6-[(1-methylpyrrolidin-3-yl)amino]pyridine-3-carboxylic acid
CID 61465352
6-N-methyl-4-N-(1-methylpyrrolidin-3-yl)-2-methylsulfanylpyrimidine-4,6-diamine
CID 80802965

Frequently Asked Questions

What is the IUPAC name of 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine?
The IUPAC name of 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine (CID 79826028) is 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine.
What is the SMILES notation for 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine?
The canonical SMILES for 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine is CN1CCC(Nc2ccc(N)c(N)n2)C1.
What is the InChIKey of 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine?
The InChIKey is QZMMHKNEZBKIHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-15-5-4-7(6-15)13-9-3-2-8(11)10(12)14-9/h2-3,7H,4-6,11H2,1H3,(H3,12,13,14).
What are the key properties of 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine?
6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine has a molecular weight of 207.28 g/mol, XLogP of 0.36, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine is sourced from PubChem (CID 79826028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).