[2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol

C16H26N2O — CID 83962394

IUPAC[2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol
SMILESCCNc1ccc(NCC2CCCCC2CO)cc1
InChIInChI=1S/C16H26N2O/c1-2-17-15-7-9-16(10-8-15)18-11-13-5-3-4-6-14(13)12-19/h7-10,13-14,17-19H,2-6,11-12H2,1H3
InChIKeyJNTHJQPVJNSKLK-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.33
Rot. Bonds6

About [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol

[2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol (PubChem CID 83962394) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol
PubChem CID83962394
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name[2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol
SMILESCCNc1ccc(NCC2CCCCC2CO)cc1
InChIInChI=1S/C16H26N2O/c1-2-17-15-7-9-16(10-8-15)18-11-13-5-3-4-6-14(13)12-19/h7-10,13-14,17-19H,2-6,11-12H2,1H3
InChIKeyJNTHJQPVJNSKLK-UHFFFAOYSA-N
XLogP3.33
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(3,4-dimethylanilino)methyl]cyclohexyl]methanol
CID 83961364
[2-[(4-piperidin-1-ylanilino)methyl]cyclohexyl]methanol
CID 83949101
[2-[[[5-(propylamino)-3-pyridinyl]amino]methyl]cyclohexyl]methanol
CID 104535105
2-bromo-4-[[2-(hydroxymethyl)cyclohexyl]methylamino]benzonitrile
CID 107276475
[2-[[[5-(propylamino)-3-pyridinyl]amino]methyl]cyclopentyl]methanol
CID 104535101
[2-[[[6-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]amino]methyl]cyclopentyl]methanol
CID 80959683
2-[(4-aminoanilino)methyl]cyclohexan-1-ol
CID 64930000
3-[[2-(hydroxymethyl)cyclopentyl]methylamino]benzoic acid
CID 102823120
[2-[(3-iodo-4-nitroanilino)methyl]cyclopentyl]methanol
CID 106493289
[2-[[[2-(methylamino)pyrimidin-4-yl]amino]methyl]cyclohexyl]methanol
CID 80856693
4-[(2-hydroxycyclohexyl)methylamino]benzonitrile
CID 64911456
[(1R,2R)-2-ethylcyclohexyl]methanol
CID 58154483

Frequently Asked Questions

What is the IUPAC name of [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol?
The IUPAC name of [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol (CID 83962394) is [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol?
The canonical SMILES for [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol is CCNc1ccc(NCC2CCCCC2CO)cc1.
What is the InChIKey of [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol?
The InChIKey is JNTHJQPVJNSKLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-2-17-15-7-9-16(10-8-15)18-11-13-5-3-4-6-14(13)12-19/h7-10,13-14,17-19H,2-6,11-12H2,1H3.
What are the key properties of [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol?
[2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol has a molecular weight of 262.40 g/mol, XLogP of 3.33, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[4-(ethylamino)anilino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 83962394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).