2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol

C10H14ClN3O — CID 114757217

IUPAC2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol
SMILESOCCC1(CNc2nccnc2Cl)CC1
InChIInChI=1S/C10H14ClN3O/c11-8-9(13-5-4-12-8)14-7-10(1-2-10)3-6-15/h4-5,15H,1-3,6-7H2,(H,13,14)
InChIKeyUZIGSHBANCDRNO-UHFFFAOYSA-N
MW227.69 g/mol
LogP1.70
Rot. Bonds5

About 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol

2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol (PubChem CID 114757217) has the molecular formula C10H14ClN3O and a molecular weight of 227.69 g/mol. Its IUPAC name is 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol
PubChem CID114757217
Molecular FormulaC10H14ClN3O
Molecular Weight227.69 g/mol
Exact Mass227.08
IUPAC Name2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol
SMILESOCCC1(CNc2nccnc2Cl)CC1
InChIInChI=1S/C10H14ClN3O/c11-8-9(13-5-4-12-8)14-7-10(1-2-10)3-6-15/h4-5,15H,1-3,6-7H2,(H,13,14)
InChIKeyUZIGSHBANCDRNO-UHFFFAOYSA-N
XLogP1.70
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-[[(3-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
CID 114755799
2-[1-[[(5-chloropyrimidin-4-yl)amino]methyl]cyclopropyl]ethanol
CID 105369731
1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopentan-1-ol
CID 65108811
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-[[(4-amino-6-chloro-1,3,5-triazin-2-yl)amino]methyl]cyclopropyl]ethanol
CID 114759634
4-chloro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]pyridine-2-carboxamide
CID 114751793
[2-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133496686
3-[[1-(hydroxymethyl)cyclopropyl]methylamino]pyrazine-2-carboxylic acid
CID 115455530
3-[[1-(2-methoxyethyl)cyclopropyl]methylamino]pyrazine-2-carbothioamide
CID 114112950
2-[1-[[(5-amino-2-pyridinyl)amino]methyl]cyclopropyl]ethanol
CID 114755814
N-[[1-(chloromethyl)cyclopropyl]methyl]-3-methylpyrazin-2-amine
CID 83062656

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol?
The IUPAC name of 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol (CID 114757217) is 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol.
What is the SMILES notation for 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol?
The canonical SMILES for 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol is OCCC1(CNc2nccnc2Cl)CC1.
What is the InChIKey of 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol?
The InChIKey is UZIGSHBANCDRNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c11-8-9(13-5-4-12-8)14-7-10(1-2-10)3-6-15/h4-5,15H,1-3,6-7H2,(H,13,14).
What are the key properties of 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol?
2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol has a molecular weight of 227.69 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[(3-chloropyrazin-2-yl)amino]methyl]cyclopropyl]ethanol is sourced from PubChem (CID 114757217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).