trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol

C11H17N3O — CID 94879143

IUPACtrans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol
SMILESCc1cnc(CN[C@@H]2CCC[C@H]2O)cn1
InChIInChI=1S/C11H17N3O/c1-8-5-13-9(6-12-8)7-14-10-3-2-4-11(10)15/h5-6,10-11,14-15H,2-4,7H2,1H3/t10-,11-/m1/s1
InChIKeyOEQOFIPTPNTELR-GHMZBOCLSA-N
MW207.28 g/mol
LogP0.79
Rot. Bonds3

About trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol

trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol (PubChem CID 94879143) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol
PubChem CID94879143
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Nametrans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol
SMILESCc1cnc(CN[C@@H]2CCC[C@H]2O)cn1
InChIInChI=1S/C11H17N3O/c1-8-5-13-9(6-12-8)7-14-10-3-2-4-11(10)15/h5-6,10-11,14-15H,2-4,7H2,1H3/t10-,11-/m1/s1
InChIKeyOEQOFIPTPNTELR-GHMZBOCLSA-N
XLogP0.79
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

trans-(1R,2R)-2-(pyrazin-2-ylmethylamino)cyclopentan-1-ol
CID 126846554
trans-(1R,2R)-2-[(2-methylpyrimidin-4-yl)methylamino]cyclopentan-1-ol
CID 93444311
3-cyclopropyl-N-[(5-methylpyrazin-2-yl)methyl]cyclohexan-1-amine
CID 64624211
1-N-[(5-methylpyrazin-2-yl)methyl]cyclohexane-1,3-diamine
CID 79458123
2,5-dimethyl-N-[(5-methylpyrazin-2-yl)methyl]cyclohexan-1-amine
CID 64761113
2-[(2-methyl-1,3-thiazol-4-yl)methylamino]cyclopentan-1-ol
CID 61285787
4-tert-butyl-N-[(5-methylpyrazin-2-yl)methyl]cyclohexan-1-amine
CID 62845689
trans-(1S,2S)-2-(pyridin-2-ylmethylamino)cyclopentan-1-ol
CID 93317323
cis-(1S,2R)-2-(pyridin-2-ylmethylamino)cyclohexan-1-ol
CID 93317478
trans-(1R,2R)-2-(pyridin-2-ylmethylamino)cyclohexan-1-ol
CID 93317480
trans-(1R,2R)-2-[(3-methyl-2-pyridinyl)methylamino]cyclopentan-1-ol
CID 102733463
1,2,5-trimethyl-N-[(5-methylpyrazin-2-yl)methyl]piperidin-4-amine
CID 62847170

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol?
The IUPAC name of trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol (CID 94879143) is trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol is Cc1cnc(CN[C@@H]2CCC[C@H]2O)cn1.
What is the InChIKey of trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol?
The InChIKey is OEQOFIPTPNTELR-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-5-13-9(6-12-8)7-14-10-3-2-4-11(10)15/h5-6,10-11,14-15H,2-4,7H2,1H3/t10-,11-/m1/s1.
What are the key properties of trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol?
trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol has a molecular weight of 207.28 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-[(5-methylpyrazin-2-yl)methylamino]cyclopentan-1-ol is sourced from PubChem (CID 94879143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).