N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine

C12H20N4 — CID 86329861

IUPACN-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine
SMILESC[C@@H](c1cnccn1)N(C)C1CCNCC1
InChIInChI=1S/C12H20N4/c1-10(12-9-14-7-8-15-12)16(2)11-3-5-13-6-4-11/h7-11,13H,3-6H2,1-2H3/t10-/m0/s1
InChIKeyZSDRVHYYBUTYDC-JTQLQIEISA-N
MW220.32 g/mol
LogP1.22
Rot. Bonds3

About N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine

N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine (PubChem CID 86329861) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine
PubChem CID86329861
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC NameN-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine
SMILESC[C@@H](c1cnccn1)N(C)C1CCNCC1
InChIInChI=1S/C12H20N4/c1-10(12-9-14-7-8-15-12)16(2)11-3-5-13-6-4-11/h7-11,13H,3-6H2,1-2H3/t10-/m0/s1
InChIKeyZSDRVHYYBUTYDC-JTQLQIEISA-N
XLogP1.22
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-[(1S)-1-pyridin-2-ylethyl]piperidin-4-amine
CID 86329926
N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]-1-(2-pyrazol-1-ylethyl)piperidin-4-amine
CID 124617495
N-piperidin-4-yl-N-propan-2-ylpyrazin-2-amine
CID 83837945
(3R)-N-methyl-N-(1-pyridin-2-ylethyl)pyrrolidin-3-amine;hydrochloride
CID 71637515
(1S)-N-methyl-1-pyrazin-2-yl-N-[[(2R)-pyrrolidin-2-yl]methyl]ethanamine
CID 129426014
2-[methyl(1-pyrazin-2-ylethyl)amino]acetaldehyde
CID 87598831
tert-butyl (3S)-3-[methyl(1-pyrazin-2-ylethyl)amino]pyrrolidine-1-carboxylate
CID 71633228
(1S)-N-piperidin-4-yl-1-pyrazin-2-ylethanesulfonamide
CID 97162099
2-[cyclopropyl-[(1R)-1-pyrazin-2-ylethyl]amino]ethanol
CID 96555165
(3S)-N-(1-pyrazin-2-ylethyl)pyrrolidin-3-amine
CID 71637669
N-methyl-N-piperidin-4-ylpyrazine-2-carboxamide
CID 43602062
(3S)-N-(1-pyrazin-2-ylethyl)pyrrolidin-3-amine;hydrochloride
CID 71637668

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine?
The IUPAC name of N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine (CID 86329861) is N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine.
What is the SMILES notation for N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine?
The canonical SMILES for N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine is C[C@@H](c1cnccn1)N(C)C1CCNCC1.
What is the InChIKey of N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine?
The InChIKey is ZSDRVHYYBUTYDC-JTQLQIEISA-N. The full InChI is InChI=1S/C12H20N4/c1-10(12-9-14-7-8-15-12)16(2)11-3-5-13-6-4-11/h7-11,13H,3-6H2,1-2H3/t10-/m0/s1.
What are the key properties of N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine?
N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1S)-1-pyrazin-2-ylethyl]piperidin-4-amine is sourced from PubChem (CID 86329861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).