3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine

C15H21N5O — CID 124963052

IUPAC3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
SMILESCc1cc(CN2CCC[C@@H](Cc3nccnc3N)C2)no1
InChIInChI=1S/C15H21N5O/c1-11-7-13(19-21-11)10-20-6-2-3-12(9-20)8-14-15(16)18-5-4-17-14/h4-5,7,12H,2-3,6,8-10H2,1H3,(H2,16,18)/t12-/m0/s1
InChIKeyHNHPOLFNQUZUKD-LBPRGKRZSA-N
MW287.37 g/mol
LogP1.81
Rot. Bonds4

About 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine

3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine (PubChem CID 124963052) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine.

Molecular Properties

Compound Name3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
PubChem CID124963052
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
SMILESCc1cc(CN2CCC[C@@H](Cc3nccnc3N)C2)no1
InChIInChI=1S/C15H21N5O/c1-11-7-13(19-21-11)10-20-6-2-3-12(9-20)8-14-15(16)18-5-4-17-14/h4-5,7,12H,2-3,6,8-10H2,1H3,(H2,16,18)/t12-/m0/s1
InChIKeyHNHPOLFNQUZUKD-LBPRGKRZSA-N
XLogP1.81
TPSA81.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine with MolForge

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Related Compounds

3-[[1-[(5-chloro-2-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
CID 110113122
3-[[1-(pyrimidin-5-ylmethyl)piperidin-3-yl]methyl]pyrazin-2-amine
CID 110113118
3-[[(3S)-1-(3,3,3-trifluoropropyl)piperidin-3-yl]methyl]pyrazin-2-amine
CID 125025118
3-[[1-(quinolin-6-ylmethyl)piperidin-3-yl]methyl]pyrazin-2-amine
CID 110113146
3-[[1-(1H-indol-6-ylmethyl)piperidin-3-yl]methyl]pyrazin-2-amine
CID 110113201
2-[4-[[(3R)-3-[(3-aminopyrazin-2-yl)methyl]piperidin-1-yl]methyl]phenoxy]acetic acid
CID 125019773
3-[[(3S)-1-[(1-methylbenzimidazol-2-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
CID 125024022
1-[(5-methyl-1,2-oxazol-3-yl)methyl]azetidin-3-amine
CID 65250257
3-[[(3S)-1-(1H-indol-4-ylmethyl)piperidin-3-yl]methyl]pyrazin-2-amine
CID 129490933
2-(1-methylimidazol-2-yl)-3-[[(3S)-1-(pyrazin-2-ylmethyl)piperidin-3-yl]methyl]pyrazine
CID 125021370
1-[(5-methyl-1,2-oxazol-3-yl)methyl]pyrrolidin-3-ol
CID 62917538
5-methyl-3-[[(3R)-3-(6-methylpyrazin-2-yl)piperidin-1-yl]methyl]-1,2-oxazole
CID 125012518

Frequently Asked Questions

What is the IUPAC name of 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine?
The IUPAC name of 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine (CID 124963052) is 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine.
What is the SMILES notation for 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine?
The canonical SMILES for 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine is Cc1cc(CN2CCC[C@@H](Cc3nccnc3N)C2)no1.
What is the InChIKey of 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine?
The InChIKey is HNHPOLFNQUZUKD-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H21N5O/c1-11-7-13(19-21-11)10-20-6-2-3-12(9-20)8-14-15(16)18-5-4-17-14/h4-5,7,12H,2-3,6,8-10H2,1H3,(H2,16,18)/t12-/m0/s1.
What are the key properties of 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine?
3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine has a molecular weight of 287.37 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3S)-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine is sourced from PubChem (CID 124963052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).