[1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol

C14H23N3O2 — CID 103965461

IUPAC[1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol
SMILESCOc1ccc(N)c(NCC2(CO)CCCCC2)n1
InChIInChI=1S/C14H23N3O2/c1-19-12-6-5-11(15)13(17-12)16-9-14(10-18)7-3-2-4-8-14/h5-6,18H,2-4,7-10,15H2,1H3,(H,16,17)
InChIKeyXBKXSSZFVIKZMU-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.03
Rot. Bonds5

About [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol

[1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol (PubChem CID 103965461) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol
PubChem CID103965461
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name[1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol
SMILESCOc1ccc(N)c(NCC2(CO)CCCCC2)n1
InChIInChI=1S/C14H23N3O2/c1-19-12-6-5-11(15)13(17-12)16-9-14(10-18)7-3-2-4-8-14/h5-6,18H,2-4,7-10,15H2,1H3,(H,16,17)
InChIKeyXBKXSSZFVIKZMU-UHFFFAOYSA-N
XLogP2.03
TPSA80.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol with MolForge

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Related Compounds

6-methoxy-2-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-2,3-diamine
CID 115320957
[1-[(2-amino-5-methoxyanilino)methyl]cyclohexyl]methanol
CID 103965437
2-[(3-amino-6-methoxy-2-pyridinyl)amino]ethanol;dihydrochloride
CID 3019251
[2-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 113286599
2-[(3-amino-6-methoxy-2-pyridinyl)amino]-2-(hydroxymethyl)propane-1,3-diol
CID 107845624
[1-[[(2-amino-5-methylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 103968719
[1-[[(3-methoxy-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 113371010
[1-[(3-amino-6-methoxy-2-pyridinyl)amino]-3-methylcyclohexyl]methanol
CID 115320724
6-methoxy-2-N-(2-methylprop-2-enyl)pyridine-2,3-diamine
CID 114615186
2-[[1-(3-amino-6-methoxy-2-pyridinyl)cyclohexyl]amino]ethanol
CID 69335152
[1-[[(5-amino-3-bromo-4-methyl-2-pyridinyl)amino]methyl]cyclohexyl]methanol
CID 104507130
2-N-butyl-6-methoxypyridine-2,3-diamine
CID 115320288

Frequently Asked Questions

What is the IUPAC name of [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol (CID 103965461) is [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol is COc1ccc(N)c(NCC2(CO)CCCCC2)n1.
What is the InChIKey of [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol?
The InChIKey is XBKXSSZFVIKZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-19-12-6-5-11(15)13(17-12)16-9-14(10-18)7-3-2-4-8-14/h5-6,18H,2-4,7-10,15H2,1H3,(H,16,17).
What are the key properties of [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol?
[1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol has a molecular weight of 265.36 g/mol, XLogP of 2.03, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(3-amino-6-methoxy-2-pyridinyl)amino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 103965461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).