[2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol

C16H26N2O — CID 107874762

IUPAC[2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESCC(C)(C)c1ccc(NCC2CCCC2CO)nc1
InChIInChI=1S/C16H26N2O/c1-16(2,3)14-7-8-15(18-10-14)17-9-12-5-4-6-13(12)11-19/h7-8,10,12-13,19H,4-6,9,11H2,1-3H3,(H,17,18)
InChIKeyRQAFYMNQACRQRE-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.20
Rot. Bonds4

About [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol

[2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol (PubChem CID 107874762) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
PubChem CID107874762
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name[2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESCC(C)(C)c1ccc(NCC2CCCC2CO)nc1
InChIInChI=1S/C16H26N2O/c1-16(2,3)14-7-8-15(18-10-14)17-9-12-5-4-6-13(12)11-19/h7-8,10,12-13,19H,4-6,9,11H2,1-3H3,(H,17,18)
InChIKeyRQAFYMNQACRQRE-UHFFFAOYSA-N
XLogP3.20
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol with MolForge

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Related Compounds

N-[2-(aminomethyl)cyclopentyl]-5-tert-butylpyridin-2-amine
CID 114011644
[2-[[(5-methylpyridazin-3-yl)amino]methyl]cyclopentyl]methanol
CID 106549836
2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol
CID 106504158
5-tert-butyl-N-[(3-chlorocyclopentyl)methyl]pyridin-2-amine
CID 106123930
5-tert-butyl-N-(thiolan-3-ylmethyl)pyridin-2-amine
CID 114011625
[2-[[(2-tert-butyl-6-chloropyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80951232
[1-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopropyl]methanol
CID 107874814
[2-[[[2-(methylamino)pyrimidin-4-yl]amino]methyl]cyclohexyl]methanol
CID 80856693
[2-[[(2-hydrazinylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 80925618
[2-[[(6-methoxypyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 66325187
6-[[2-(hydroxymethyl)cyclopentyl]methylamino]-2H-[1,2,4]triazolo[4,3-b]pyridazin-3-one
CID 66283816
[2-[[(6-ethoxy-2-methylpyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 66326317

Frequently Asked Questions

What is the IUPAC name of [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol (CID 107874762) is [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol is CC(C)(C)c1ccc(NCC2CCCC2CO)nc1.
What is the InChIKey of [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
The InChIKey is RQAFYMNQACRQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-16(2,3)14-7-8-15(18-10-14)17-9-12-5-4-6-13(12)11-19/h7-8,10,12-13,19H,4-6,9,11H2,1-3H3,(H,17,18).
What are the key properties of [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol?
[2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol has a molecular weight of 262.40 g/mol, XLogP of 3.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 107874762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).