4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol

C17H33NO — CID 62611313

IUPAC4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol
SMILESCCC1CCC(O)C(CN(C)C2CCC(C)CC2)C1
InChIInChI=1S/C17H33NO/c1-4-14-7-10-17(19)15(11-14)12-18(3)16-8-5-13(2)6-9-16/h13-17,19H,4-12H2,1-3H3
InChIKeyPDKVKEZOHPBDTP-UHFFFAOYSA-N
MW267.46 g/mol
LogP3.68
Rot. Bonds4

About 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol

4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol (PubChem CID 62611313) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol
PubChem CID62611313
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC Name4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol
SMILESCCC1CCC(O)C(CN(C)C2CCC(C)CC2)C1
InChIInChI=1S/C17H33NO/c1-4-14-7-10-17(19)15(11-14)12-18(3)16-8-5-13(2)6-9-16/h13-17,19H,4-12H2,1-3H3
InChIKeyPDKVKEZOHPBDTP-UHFFFAOYSA-N
XLogP3.68
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

2-[[methyl-(4-methylcyclohexyl)amino]methyl]cycloheptan-1-ol
CID 62611154
2-[[cyclohexylmethyl(methyl)amino]methyl]-4-ethylcyclohexan-1-ol
CID 63488742
4-methyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 62609711
4-ethyl-2-[[methyl(2-methylpropyl)amino]methyl]cyclohexan-1-ol
CID 62611284
4-ethyl-2-[[(4-fluorophenyl)methyl-methylamino]methyl]cyclohexan-1-ol
CID 62609412
2-[[3,3-dimethylbutan-2-yl(methyl)amino]methyl]-4-ethylcyclohexan-1-ol
CID 62608874
4-ethyl-2-[[2-hydroxyethyl(propyl)amino]methyl]cyclohexan-1-ol
CID 55094394
2-[[methyl-(1-methylpiperidin-3-yl)amino]methyl]-4-propylcyclohexan-1-ol
CID 62609589
4-ethyl-2-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 62610434
4-methyl-2-[[methyl(oxolan-3-yl)amino]methyl]cyclohexan-1-ol
CID 82754506
2-[[butan-2-yl(ethyl)amino]methyl]-4-ethylcyclohexan-1-ol
CID 55094767
2-[(N-butylanilino)methyl]-4-ethylcyclohexan-1-ol
CID 64585632

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol (CID 62611313) is 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol is CCC1CCC(O)C(CN(C)C2CCC(C)CC2)C1.
What is the InChIKey of 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is PDKVKEZOHPBDTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO/c1-4-14-7-10-17(19)15(11-14)12-18(3)16-8-5-13(2)6-9-16/h13-17,19H,4-12H2,1-3H3.
What are the key properties of 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol?
4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 267.46 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-[[methyl-(4-methylcyclohexyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 62611313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).