1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol

C16H32N2O — CID 62614983

IUPAC1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol
SMILESCC(C)(C)C1CCC(N)C(CN2CCC(O)CC2)C1
InChIInChI=1S/C16H32N2O/c1-16(2,3)13-4-5-15(17)12(10-13)11-18-8-6-14(19)7-9-18/h12-15,19H,4-11,17H2,1-3H3
InChIKeyNPOUTZICWILWAX-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.23
Rot. Bonds2

About 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol

1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol (PubChem CID 62614983) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol
PubChem CID62614983
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol
SMILESCC(C)(C)C1CCC(N)C(CN2CCC(O)CC2)C1
InChIInChI=1S/C16H32N2O/c1-16(2,3)13-4-5-15(17)12(10-13)11-18-8-6-14(19)7-9-18/h12-15,19H,4-11,17H2,1-3H3
InChIKeyNPOUTZICWILWAX-UHFFFAOYSA-N
XLogP2.23
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(2-amino-5-tert-butylcyclohexyl)methyl]pyrrolidin-3-ol
CID 62943220
4-tert-butyl-2-[(4-methylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 62615514
1-[(2-amino-5-tert-butylcyclohexyl)methyl]pyrrolidine-3,4-diol
CID 106674063
4-tert-butyl-2-(1,3-dihydroisoindol-2-ylmethyl)cyclohexan-1-amine
CID 62611169
4-tert-butyl-2-[(2,2-dimethylmorpholin-4-yl)methyl]cyclohexan-1-amine
CID 62616805
4-tert-butyl-2-(thiomorpholin-4-ylmethyl)cyclohexan-1-ol
CID 62609534
4-tert-butyl-2-[(2-methyl-1,4-oxazepan-4-yl)methyl]cyclohexan-1-amine
CID 62974601
4-tert-butyl-2-[(4-methyl-1,4-diazepan-1-yl)methyl]cyclohexan-1-ol
CID 62610754
1-[(2-amino-5-propan-2-ylcyclohexyl)methyl]pyrrolidin-3-ol
CID 62943988
4-tert-butyl-2-[(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methyl]cyclohexan-1-amine
CID 102886488
4-tert-butyl-2-[(4-ethylpiperazin-1-yl)methyl]-N-methylcyclohexan-1-amine
CID 62614453
1-[2-(aminomethyl)-5-tert-butylcyclohexyl]pyrrolidin-3-ol
CID 62941504

Frequently Asked Questions

What is the IUPAC name of 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol?
The IUPAC name of 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol (CID 62614983) is 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol.
What is the SMILES notation for 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol?
The canonical SMILES for 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol is CC(C)(C)C1CCC(N)C(CN2CCC(O)CC2)C1.
What is the InChIKey of 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol?
The InChIKey is NPOUTZICWILWAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-16(2,3)13-4-5-15(17)12(10-13)11-18-8-6-14(19)7-9-18/h12-15,19H,4-11,17H2,1-3H3.
What are the key properties of 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol?
1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol has a molecular weight of 268.44 g/mol, XLogP of 2.23, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-amino-5-tert-butylcyclohexyl)methyl]piperidin-4-ol is sourced from PubChem (CID 62614983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).