N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine

C16H22N6 — CID 110095072

IUPACN,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
SMILESCN(C)c1nccnc1CC1CCCN(c2cnccn2)C1
InChIInChI=1S/C16H22N6/c1-21(2)16-14(18-7-8-20-16)10-13-4-3-9-22(12-13)15-11-17-5-6-19-15/h5-8,11,13H,3-4,9-10,12H2,1-2H3
InChIKeyPQYLOJZTQOZOHQ-UHFFFAOYSA-N
MW298.39 g/mol
LogP1.79
Rot. Bonds4

About N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine

N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine (PubChem CID 110095072) has the molecular formula C16H22N6 and a molecular weight of 298.39 g/mol. Its IUPAC name is N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
PubChem CID110095072
Molecular FormulaC16H22N6
Molecular Weight298.39 g/mol
Exact Mass298.19
IUPAC NameN,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
SMILESCN(C)c1nccnc1CC1CCCN(c2cnccn2)C1
InChIInChI=1S/C16H22N6/c1-21(2)16-14(18-7-8-20-16)10-13-4-3-9-22(12-13)15-11-17-5-6-19-15/h5-8,11,13H,3-4,9-10,12H2,1-2H3
InChIKeyPQYLOJZTQOZOHQ-UHFFFAOYSA-N
XLogP1.79
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
CID 110095070
2-[(3R)-3-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
CID 95840910
2-[(3S)-3-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
CID 95840909
2-(3-ethylpiperidin-1-yl)pyrazine
CID 146424567
2-(2,3-dimethylimidazol-4-yl)-3-[[(3R)-1-pyrazin-2-ylpiperidin-3-yl]methyl]pyrazine
CID 125004932
2-[3-(bromomethyl)piperidin-1-yl]pyrazine
CID 80674587
(3R)-3-[[3-(dimethylamino)pyrazin-2-yl]methyl]-N,N-dimethylpiperidine-1-sulfonamide
CID 125014655
N-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]propan-1-amine
CID 62586883
(3S)-1-pyrazin-2-ylpiperidin-3-amine
CID 86277059
3-[[3-(dimethylamino)pyrazin-2-yl]methyl]-N,N-diethylpiperidine-1-sulfonamide
CID 110113337
(3S)-N-methyl-1-pyrazin-2-ylpiperidin-3-amine
CID 94476433
[(3S)-3-[[3-(dimethylamino)pyrazin-2-yl]methyl]piperidin-1-yl]-(1-methylimidazol-2-yl)methanone
CID 124976884

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The IUPAC name of N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine (CID 110095072) is N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine.
What is the SMILES notation for N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The canonical SMILES for N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine is CN(C)c1nccnc1CC1CCCN(c2cnccn2)C1.
What is the InChIKey of N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
The InChIKey is PQYLOJZTQOZOHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N6/c1-21(2)16-14(18-7-8-20-16)10-13-4-3-9-22(12-13)15-11-17-5-6-19-15/h5-8,11,13H,3-4,9-10,12H2,1-2H3.
What are the key properties of N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine?
N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine has a molecular weight of 298.39 g/mol, XLogP of 1.79, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine is sourced from PubChem (CID 110095072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).