3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine

C12H21N5 — CID 62673591

IUPAC3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine
SMILESCN1CCCC(N(C)c2nccnc2CN)C1
InChIInChI=1S/C12H21N5/c1-16-7-3-4-10(9-16)17(2)12-11(8-13)14-5-6-15-12/h5-6,10H,3-4,7-9,13H2,1-2H3
InChIKeyHNPFGHRAEANJCX-UHFFFAOYSA-N
MW235.33 g/mol
LogP0.47
Rot. Bonds3

About 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine

3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine (PubChem CID 62673591) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine
PubChem CID62673591
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine
SMILESCN1CCCC(N(C)c2nccnc2CN)C1
InChIInChI=1S/C12H21N5/c1-16-7-3-4-10(9-16)17(2)12-11(8-13)14-5-6-15-12/h5-6,10H,3-4,7-9,13H2,1-2H3
InChIKeyHNPFGHRAEANJCX-UHFFFAOYSA-N
XLogP0.47
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine
CID 105389734
5-chloro-4-[methyl-(1-methylpiperidin-3-yl)amino]-1H-pyrimidin-6-one
CID 136971235
4-N-methyl-4-N-(1-methylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80832213
6-chloro-N-methyl-N-(1-methylpiperidin-3-yl)-5-propylpyrimidin-4-amine
CID 63729519
N-methyl-5-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine
CID 114216274
5-(chloromethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyridin-2-amine
CID 55084380
6-hydrazinyl-N-methyl-N-(1-methylpiperidin-3-yl)-5-propan-2-ylpyrimidin-4-amine
CID 80919618
6-chloro-2-ethyl-N,5-dimethyl-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine
CID 80971369
3-(2-aminoethyl)-N-methyl-N-(1-methylpiperidin-3-yl)imidazo[1,2-a]pyridin-2-amine
CID 63782587
2-N,4-N-dimethyl-4-N-(1-methylpiperidin-3-yl)pyridine-2,4-diamine
CID 113367781
3,6-dichloro-N-methyl-N-(1-methylpiperidin-3-yl)-1,2,4-triazin-5-amine
CID 81036366
6-chloro-N,5-dimethyl-N-(1-methylpiperidin-3-yl)-2-propylpyrimidin-4-amine
CID 80972660

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine?
The IUPAC name of 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine (CID 62673591) is 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine?
The canonical SMILES for 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine is CN1CCCC(N(C)c2nccnc2CN)C1.
What is the InChIKey of 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine?
The InChIKey is HNPFGHRAEANJCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-16-7-3-4-10(9-16)17(2)12-11(8-13)14-5-6-15-12/h5-6,10H,3-4,7-9,13H2,1-2H3.
What are the key properties of 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine?
3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine has a molecular weight of 235.33 g/mol, XLogP of 0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine is sourced from PubChem (CID 62673591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).