(5R)-2-methyl-5-(methylamino)cyclohexan-1-ol

C8H17NO — CID 176717328

IUPAC(5R)-2-methyl-5-(methylamino)cyclohexan-1-ol
SMILESCN[C@@H]1CCC(C)C(O)C1
InChIInChI=1S/C8H17NO/c1-6-3-4-7(9-2)5-8(6)10/h6-10H,3-5H2,1-2H3/t6?,7-,8?/m1/s1
InChIKeyPNQDMYRDTAINGA-ZUEIMRROSA-N
MW143.23 g/mol
LogP0.76
Rot. Bonds1

About (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol

(5R)-2-methyl-5-(methylamino)cyclohexan-1-ol (PubChem CID 176717328) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol.

Molecular Properties

Compound Name(5R)-2-methyl-5-(methylamino)cyclohexan-1-ol
PubChem CID176717328
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(5R)-2-methyl-5-(methylamino)cyclohexan-1-ol
SMILESCN[C@@H]1CCC(C)C(O)C1
InChIInChI=1S/C8H17NO/c1-6-3-4-7(9-2)5-8(6)10/h6-10H,3-5H2,1-2H3/t6?,7-,8?/m1/s1
InChIKeyPNQDMYRDTAINGA-ZUEIMRROSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[(1R,3S,4S)-3-hydroxy-4-methylcyclohexyl]carbamic acid
CID 89396263
(3-hydroxy-4-methylcyclohexyl)carbamic acid
CID 89157990
(1R,2R,5S)-2,5-dimethylcyclohexan-1-ol
CID 12794034
N-(3-hydroxy-4-methylcyclohexyl)cyclopentanecarboxamide
CID 58477543
potassium 2,5-dimethylcyclohexan-1-ol
CID 18764424
lithium 2,5-dimethylcyclohexan-1-ol
CID 18764144
trans-(1S,4S)-4-methylcyclohexane-1,3-diol
CID 142273228
tert-butyl N-[(1R,4S)-3-hydroxy-4-methylcyclohexyl]carbamate
CID 118263188
tert-butyl N-[(1R,3R)-3-hydroxy-4-methylcyclohexyl]carbamate
CID 118263190
3-(methylamino)cyclopentan-1-ol;hydrochloride
CID 162422237
(2R)-2-amino-N-[(1S,3S,4S)-3-hydroxy-4-methylcyclohexyl]-3-methylbutanamide
CID 58369423
2,5-dimethylcyclohexan-1-ol;propane
CID 142087287

Frequently Asked Questions

What is the IUPAC name of (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol?
The IUPAC name of (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol (CID 176717328) is (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol.
What is the SMILES notation for (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol?
The canonical SMILES for (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol is CN[C@@H]1CCC(C)C(O)C1.
What is the InChIKey of (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol?
The InChIKey is PNQDMYRDTAINGA-ZUEIMRROSA-N. The full InChI is InChI=1S/C8H17NO/c1-6-3-4-7(9-2)5-8(6)10/h6-10H,3-5H2,1-2H3/t6?,7-,8?/m1/s1.
What are the key properties of (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol?
(5R)-2-methyl-5-(methylamino)cyclohexan-1-ol has a molecular weight of 143.23 g/mol, XLogP of 0.76, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-2-methyl-5-(methylamino)cyclohexan-1-ol is sourced from PubChem (CID 176717328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).