[1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol

C14H28N2O — CID 79641278

IUPAC[1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol
SMILESCC1CCC(C)N(C2CCCC(N)(CO)C2)C1
InChIInChI=1S/C14H28N2O/c1-11-5-6-12(2)16(9-11)13-4-3-7-14(15,8-13)10-17/h11-13,17H,3-10,15H2,1-2H3
InChIKeyFBDBGPKPOSVQAN-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.74
Rot. Bonds2

About [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol

[1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol (PubChem CID 79641278) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol.

Molecular Properties

Compound Name[1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol
PubChem CID79641278
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol
SMILESCC1CCC(C)N(C2CCCC(N)(CO)C2)C1
InChIInChI=1S/C14H28N2O/c1-11-5-6-12(2)16(9-11)13-4-3-7-14(15,8-13)10-17/h11-13,17H,3-10,15H2,1-2H3
InChIKeyFBDBGPKPOSVQAN-UHFFFAOYSA-N
XLogP1.74
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-amino-3-(5-ethyl-2-methylpiperidin-1-yl)cyclopentyl]methanol
CID 112734609
[3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexyl]methanol
CID 79640098
[1-amino-3-(3,4-dimethylpiperazin-1-yl)cyclohexyl]methanol
CID 79634080
[3-(2,5-dimethylpiperidin-1-yl)-1-(propan-2-ylamino)cyclopentyl]methanol
CID 79656392
3-(2,5-dimethylpiperidin-1-yl)-1-(ethylamino)cyclohexane-1-carboxylic acid
CID 79641319
[1-amino-3-(2-cyclopentylpyrrolidin-1-yl)cyclohexyl]methanol
CID 79640087
[1-amino-3-(3-propylpyrrolidin-1-yl)cyclohexyl]methanol
CID 113419340
[1-amino-3-(3,5-dimethylpiperidin-1-yl)cyclopentyl]methanol
CID 79656844
[1-amino-3-(3-ethylpiperidin-1-yl)cyclohexyl]methanol
CID 79640939
[3-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-1-aminocyclohexyl]methanol
CID 79640625
(1-amino-3-methylcyclopentyl)methanol
CID 64516223
[1-amino-3-[4-(methoxymethyl)piperidin-1-yl]cyclohexyl]methanol
CID 79634523

Frequently Asked Questions

What is the IUPAC name of [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol?
The IUPAC name of [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol (CID 79641278) is [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol.
What is the SMILES notation for [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol?
The canonical SMILES for [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol is CC1CCC(C)N(C2CCCC(N)(CO)C2)C1.
What is the InChIKey of [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol?
The InChIKey is FBDBGPKPOSVQAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11-5-6-12(2)16(9-11)13-4-3-7-14(15,8-13)10-17/h11-13,17H,3-10,15H2,1-2H3.
What are the key properties of [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol?
[1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol has a molecular weight of 240.39 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-amino-3-(2,5-dimethylpiperidin-1-yl)cyclohexyl]methanol is sourced from PubChem (CID 79641278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).