[1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol

C11H18N4O — CID 79478877

IUPAC[1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol
SMILESCCNc1cncc(NCC2(CO)CC2)n1
InChIInChI=1S/C11H18N4O/c1-2-13-9-5-12-6-10(15-9)14-7-11(8-16)3-4-11/h5-6,16H,2-4,7-8H2,1H3,(H2,13,14,15)
InChIKeyXJLJQKUMMFFYKA-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.09
Rot. Bonds6

About [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol

[1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol (PubChem CID 79478877) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol
PubChem CID79478877
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name[1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol
SMILESCCNc1cncc(NCC2(CO)CC2)n1
InChIInChI=1S/C11H18N4O/c1-2-13-9-5-12-6-10(15-9)14-7-11(8-16)3-4-11/h5-6,16H,2-4,7-8H2,1H3,(H2,13,14,15)
InChIKeyXJLJQKUMMFFYKA-UHFFFAOYSA-N
XLogP1.09
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-ethyl-2-N-[(1-ethylcyclopropyl)methyl]pyrazine-2,6-diamine
CID 103736833
1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclohexan-1-ol
CID 80843498
methyl 6-[[1-(hydroxymethyl)cyclopropyl]methylamino]pyrazine-2-carboxylate
CID 115455097
[1-[[[6-(ethylamino)-2-methylsulfanylpyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
CID 113313781
[1-[[[2-(ethylamino)pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
CID 115457191
[1-[[[6-(ethylamino)pyrimidin-4-yl]amino]methyl]cyclohexyl]methanol
CID 103968726
[1-[[6-(ethylamino)pyrazin-2-yl]amino]-4-methylcyclohexyl]methanol
CID 80832803
6-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]pyrazine-2-carboxamide
CID 133496605
[1-[[(6-amino-2-propylpyrimidin-4-yl)amino]methyl]cyclopropyl]methanol
CID 115457185
[1-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopropyl]methanol
CID 107874814
[1-[(pyrazin-2-ylamino)methyl]cyclopentyl]methanol
CID 115360623
3-[[6-(ethylamino)pyrazin-2-yl]amino]-2-methylpropane-1,2-diol
CID 80851576

Frequently Asked Questions

What is the IUPAC name of [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol (CID 79478877) is [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol is CCNc1cncc(NCC2(CO)CC2)n1.
What is the InChIKey of [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol?
The InChIKey is XJLJQKUMMFFYKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-2-13-9-5-12-6-10(15-9)14-7-11(8-16)3-4-11/h5-6,16H,2-4,7-8H2,1H3,(H2,13,14,15).
What are the key properties of [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol?
[1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol has a molecular weight of 222.29 g/mol, XLogP of 1.09, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[[6-(ethylamino)pyrazin-2-yl]amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 79478877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).