N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine

C13H18N4 — CID 82877517

IUPACN-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine
SMILESCNC(Cc1ccn(C)n1)c1cccc(C)n1
InChIInChI=1S/C13H18N4/c1-10-5-4-6-12(15-10)13(14-2)9-11-7-8-17(3)16-11/h4-8,13-14H,9H2,1-3H3
InChIKeyRIXBMCYOJDUTJW-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.63
Rot. Bonds4

About N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine

N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine (PubChem CID 82877517) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine
PubChem CID82877517
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC NameN-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine
SMILESCNC(Cc1ccn(C)n1)c1cccc(C)n1
InChIInChI=1S/C13H18N4/c1-10-5-4-6-12(15-10)13(14-2)9-11-7-8-17(3)16-11/h4-8,13-14H,9H2,1-3H3
InChIKeyRIXBMCYOJDUTJW-UHFFFAOYSA-N
XLogP1.63
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-(1-methylpyrazol-3-yl)-1-naphthalen-1-ylethanamine
CID 82876005
(2S)-2-(methylamino)-2-(6-methyl-2-pyridinyl)ethanol
CID 55277338
1-(2-iodo-3-methylphenyl)-N-methyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 114030234
1-(2-bromo-3-methylphenyl)-N-methyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 114024237
N-methyl-2-(1-methylpyrazol-3-yl)-1-(1,3-thiazol-4-yl)ethanamine
CID 82876547
N-methyl-1-(1-methylpyrazol-3-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 65200899
N-methyl-1-(1-methylimidazol-2-yl)-2-(1-methylpyrazol-3-yl)ethanamine
CID 82876706
N-methyl-1-(6-methyl-2-pyridinyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 79752583
1-(4-bromophenyl)-N-methyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 82876754
2-(4-iodophenyl)-N-methyl-1-(6-methyl-2-pyridinyl)ethanamine
CID 65478941
1-(3-ethyl-1-methylpyrazol-4-yl)-N-methyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 102812738
N-methyl-1-(5-methylfuran-3-yl)-2-(1-methylpyrazol-3-yl)ethanamine
CID 105025275

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine?
The IUPAC name of N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine (CID 82877517) is N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine is CNC(Cc1ccn(C)n1)c1cccc(C)n1.
What is the InChIKey of N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine?
The InChIKey is RIXBMCYOJDUTJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-10-5-4-6-12(15-10)13(14-2)9-11-7-8-17(3)16-11/h4-8,13-14H,9H2,1-3H3.
What are the key properties of N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine?
N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine has a molecular weight of 230.31 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-methylpyrazol-3-yl)-1-(6-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 82877517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).