N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine

C9H15N5 — CID 112709657

IUPACN-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine
SMILESCN(CC1CCNC1)c1cncnn1
InChIInChI=1S/C9H15N5/c1-14(6-8-2-3-10-4-8)9-5-11-7-12-13-9/h5,7-8,10H,2-4,6H2,1H3
InChIKeyZCHJFXFGPDUVLV-UHFFFAOYSA-N
MW193.25 g/mol
LogP-0.08
Rot. Bonds3

About N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine

N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine (PubChem CID 112709657) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine.

Molecular Properties

Compound NameN-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine
PubChem CID112709657
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC NameN-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine
SMILESCN(CC1CCNC1)c1cncnn1
InChIInChI=1S/C9H15N5/c1-14(6-8-2-3-10-4-8)9-5-11-7-12-13-9/h5,7-8,10H,2-4,6H2,1H3
InChIKeyZCHJFXFGPDUVLV-UHFFFAOYSA-N
XLogP-0.08
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,6-dimethyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 97164558
6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 97164559
6-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)pyridazin-3-amine
CID 116973542
N-methyl-N-(piperidin-3-ylmethyl)pyrazin-2-amine;hydrochloride
CID 71642141
N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine
CID 112709455
N-methyl-6-phenyl-N-(pyrrolidin-3-ylmethyl)pyridazin-3-amine
CID 116973535
5-chloro-N-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 106642815
5-iodo-N-methyl-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 106642624
6-bromo-N-methyl-N-(pyrrolidin-3-ylmethyl)pyridin-2-amine;hydrochloride
CID 71642240
N,5-dimethyl-N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-2-amine
CID 112709751
N,3-dimethyl-N-(pyrrolidin-3-ylmethyl)pyrazin-2-amine;hydrochloride
CID 71642284
6-(7-fluoro-1-benzofuran-6-yl)-N-methyl-N-(pyrrolidin-3-ylmethyl)pyrazin-2-amine
CID 155960304

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine?
The IUPAC name of N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine (CID 112709657) is N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine.
What is the SMILES notation for N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine?
The canonical SMILES for N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine is CN(CC1CCNC1)c1cncnn1.
What is the InChIKey of N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine?
The InChIKey is ZCHJFXFGPDUVLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c1-14(6-8-2-3-10-4-8)9-5-11-7-12-13-9/h5,7-8,10H,2-4,6H2,1H3.
What are the key properties of N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine?
N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine has a molecular weight of 193.25 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine is sourced from PubChem (CID 112709657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).