1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol

C10H14ClN3O — CID 65108811

IUPAC1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol
SMILESOC1(CNc2nccnc2Cl)CCCC1
InChIInChI=1S/C10H14ClN3O/c11-8-9(13-6-5-12-8)14-7-10(15)3-1-2-4-10/h5-6,15H,1-4,7H2,(H,13,14)
InChIKeySCMJTCIXCZYDKY-UHFFFAOYSA-N
MW227.69 g/mol
LogP1.85
Rot. Bonds3

About 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol

1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol (PubChem CID 65108811) has the molecular formula C10H14ClN3O and a molecular weight of 227.69 g/mol. Its IUPAC name is 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol
PubChem CID65108811
Molecular FormulaC10H14ClN3O
Molecular Weight227.69 g/mol
Exact Mass227.08
IUPAC Name1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol
SMILESOC1(CNc2nccnc2Cl)CCCC1
InChIInChI=1S/C10H14ClN3O/c11-8-9(13-6-5-12-8)14-7-10(15)3-1-2-4-10/h5-6,15H,1-4,7H2,(H,13,14)
InChIKeySCMJTCIXCZYDKY-UHFFFAOYSA-N
XLogP1.85
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[(3-chloropyrazin-2-yl)amino]methyl]cycloheptan-1-ol
CID 65122500
3-chloro-N-[[1-(dimethylamino)cyclopentyl]methyl]pyrazin-2-amine
CID 83112048
2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol
CID 114757217
3-[(1-hydroxycyclopentyl)methylamino]-1H-pyrazin-2-one
CID 115677846
1-[[(2-chloro-5-methylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 79073024
1-[[(5-chloro-2-methoxypyrimidin-4-yl)amino]methyl]cycloheptan-1-ol
CID 80757941
1-[[(2-chloro-5-fluoropyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 79075802
1-[[(5-chloro-3-fluoro-2-pyridinyl)amino]methyl]cycloheptan-1-ol
CID 79728355
1-[[(3-bromo-5-chloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 114835960
1-[(pyrazolo[1,5-a]pyrazin-4-ylamino)methyl]cyclopentan-1-ol
CID 113446380
1-[[(1-methylimidazo[4,5-c]pyridin-4-yl)amino]methyl]cyclopentan-1-ol
CID 103385664
1-[[(2-chloro-4-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 103911762

Frequently Asked Questions

What is the IUPAC name of 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol (CID 65108811) is 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol is OC1(CNc2nccnc2Cl)CCCC1.
What is the InChIKey of 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol?
The InChIKey is SCMJTCIXCZYDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c11-8-9(13-6-5-12-8)14-7-10(15)3-1-2-4-10/h5-6,15H,1-4,7H2,(H,13,14).
What are the key properties of 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol?
1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol has a molecular weight of 227.69 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65108811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).