[2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol

C12H17Cl2N3O — CID 102758815

IUPAC[2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESNc1nc(NCC2CCCC2CO)c(Cl)cc1Cl
InChIInChI=1S/C12H17Cl2N3O/c13-9-4-10(14)12(17-11(9)15)16-5-7-2-1-3-8(7)6-18/h4,7-8,18H,1-3,5-6H2,(H3,15,16,17)
InChIKeyZUPRFWQGJKTPPZ-UHFFFAOYSA-N
MW290.19 g/mol
LogP2.79
Rot. Bonds4

About [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol

[2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol (PubChem CID 102758815) has the molecular formula C12H17Cl2N3O and a molecular weight of 290.19 g/mol. Its IUPAC name is [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol
PubChem CID102758815
Molecular FormulaC12H17Cl2N3O
Molecular Weight290.19 g/mol
Exact Mass289.07
IUPAC Name[2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESNc1nc(NCC2CCCC2CO)c(Cl)cc1Cl
InChIInChI=1S/C12H17Cl2N3O/c13-9-4-10(14)12(17-11(9)15)16-5-7-2-1-3-8(7)6-18/h4,7-8,18H,1-3,5-6H2,(H3,15,16,17)
InChIKeyZUPRFWQGJKTPPZ-UHFFFAOYSA-N
XLogP2.79
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.19
LogP ≤ 52.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol with MolForge

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Related Compounds

2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclohexan-1-ol
CID 102758635
[2-[[(3,5,6-trichloro-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 102751354
3,5-dichloro-6-N-[(1-methylpiperidin-3-yl)methyl]pyridine-2,6-diamine
CID 102757522
3,5-dichloro-2-N-ethyl-6-N-[(2-methylcyclopentyl)methyl]pyridine-2,6-diamine
CID 107421190
4-[(6-amino-3,5-dichloro-2-pyridinyl)amino]butan-1-ol
CID 106847028
3,5-dichloro-6-N-ethylpyridine-2,6-diamine
CID 102755516
[2-[[(6-amino-2-methylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80855981
[2-[[(6-amino-2-cyclopropylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80959887
[2-[[(3-amino-5-methyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 66278240
3,5,6-trichloro-N-[(2-methylcyclohexyl)methyl]pyridin-2-amine
CID 102750821
3-[(6-amino-3,5-dichloro-2-pyridinyl)amino]-2-methylpropane-1,2-diol
CID 102758876
3,5-dichloro-6-N-[2-[cyclopropyl(methyl)amino]propyl]pyridine-2,6-diamine
CID 114133461

Frequently Asked Questions

What is the IUPAC name of [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol (CID 102758815) is [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol is Nc1nc(NCC2CCCC2CO)c(Cl)cc1Cl.
What is the InChIKey of [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The InChIKey is ZUPRFWQGJKTPPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17Cl2N3O/c13-9-4-10(14)12(17-11(9)15)16-5-7-2-1-3-8(7)6-18/h4,7-8,18H,1-3,5-6H2,(H3,15,16,17).
What are the key properties of [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
[2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol has a molecular weight of 290.19 g/mol, XLogP of 2.79, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(6-amino-3,5-dichloro-2-pyridinyl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 102758815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).