6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine

C18H25N5O2 — CID 91796579

IUPAC6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine
SMILESCN(C)Cc1cncc(N[C@@H]2CCOC[C@H]2OCc2ccccn2)n1
InChIInChI=1S/C18H25N5O2/c1-23(2)11-15-9-19-10-18(21-15)22-16-6-8-24-13-17(16)25-12-14-5-3-4-7-20-14/h3-5,7,9-10,16-17H,6,8,11-13H2,1-2H3,(H,21,22)/t16-,17-/m1/s1
InChIKeyCDVGVQLRNWHVAF-IAGOWNOFSA-N
MW343.43 g/mol
LogP1.72
Rot. Bonds7

About 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine

6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine (PubChem CID 91796579) has the molecular formula C18H25N5O2 and a molecular weight of 343.43 g/mol. Its IUPAC name is 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine.

Molecular Properties

Compound Name6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine
PubChem CID91796579
Molecular FormulaC18H25N5O2
Molecular Weight343.43 g/mol
Exact Mass343.20
IUPAC Name6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine
SMILESCN(C)Cc1cncc(N[C@@H]2CCOC[C@H]2OCc2ccccn2)n1
InChIInChI=1S/C18H25N5O2/c1-23(2)11-15-9-19-10-18(21-15)22-16-6-8-24-13-17(16)25-12-14-5-3-4-7-20-14/h3-5,7,9-10,16-17H,6,8,11-13H2,1-2H3,(H,21,22)/t16-,17-/m1/s1
InChIKeyCDVGVQLRNWHVAF-IAGOWNOFSA-N
XLogP1.72
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine with MolForge

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Related Compounds

N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]quinoxalin-2-amine
CID 91787366
N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]quinazolin-4-amine
CID 91771429
2-acetamido-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]acetamide
CID 91767025
2-ethoxy-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyridine-3-carboxamide
CID 91764796
N-[(3S,4R)-3-ethoxyoxan-4-yl]quinoxalin-2-amine
CID 91760488
4-methyl-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]piperazine-1-sulfonamide
CID 91773150
N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]imidazo[1,2-a]pyridine-6-carboxamide
CID 91777996
2-(1,3-benzodioxol-5-yl)-N-[3-(pyridin-2-ylmethoxy)oxan-4-yl]acetamide
CID 156609865
3-ethyl-5-methyl-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]-1,2-oxazole-4-carboxamide
CID 91797644
N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]-2-thiophen-3-ylacetamide
CID 91759680
2-(4-methylpyrimidin-2-yl)sulfanyl-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]acetamide
CID 91782411
3-cyclopropyl-5-methyl-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]-1H-pyrazole-4-carboxamide
CID 91786206

Frequently Asked Questions

What is the IUPAC name of 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine?
The IUPAC name of 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine (CID 91796579) is 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine.
What is the SMILES notation for 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine?
The canonical SMILES for 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine is CN(C)Cc1cncc(N[C@@H]2CCOC[C@H]2OCc2ccccn2)n1.
What is the InChIKey of 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine?
The InChIKey is CDVGVQLRNWHVAF-IAGOWNOFSA-N. The full InChI is InChI=1S/C18H25N5O2/c1-23(2)11-15-9-19-10-18(21-15)22-16-6-8-24-13-17(16)25-12-14-5-3-4-7-20-14/h3-5,7,9-10,16-17H,6,8,11-13H2,1-2H3,(H,21,22)/t16-,17-/m1/s1.
What are the key properties of 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine?
6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine has a molecular weight of 343.43 g/mol, XLogP of 1.72, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(dimethylamino)methyl]-N-[(3S,4R)-3-(pyridin-2-ylmethoxy)oxan-4-yl]pyrazin-2-amine is sourced from PubChem (CID 91796579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).