2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol

C15H31NO — CID 62609389

IUPAC2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol
SMILESCC(C)CN(CC(C)C)CC1CCCCC1O
InChIInChI=1S/C15H31NO/c1-12(2)9-16(10-13(3)4)11-14-7-5-6-8-15(14)17/h12-15,17H,5-11H2,1-4H3
InChIKeyNZYQTFOVOBPQDE-UHFFFAOYSA-N
MW241.42 g/mol
LogP3.15
Rot. Bonds6

About 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol

2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol (PubChem CID 62609389) has the molecular formula C15H31NO and a molecular weight of 241.42 g/mol. Its IUPAC name is 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol
PubChem CID62609389
Molecular FormulaC15H31NO
Molecular Weight241.42 g/mol
Exact Mass241.24
IUPAC Name2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol
SMILESCC(C)CN(CC(C)C)CC1CCCCC1O
InChIInChI=1S/C15H31NO/c1-12(2)9-16(10-13(3)4)11-14-7-5-6-8-15(14)17/h12-15,17H,5-11H2,1-4H3
InChIKeyNZYQTFOVOBPQDE-UHFFFAOYSA-N
XLogP3.15
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.42
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[cyclopropylmethyl(ethyl)amino]methyl]cyclohexan-1-ol
CID 63938716
2-[[cyclopropylmethyl(ethyl)amino]methyl]cycloheptan-1-ol
CID 63939487
2-[[butan-2-yl(methyl)amino]methyl]cycloheptan-1-ol
CID 62611279
2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol
CID 62608844
2-[[cyclopropyl(methyl)amino]methyl]cycloheptan-1-ol
CID 62609891
2-[[ethyl(2-methoxyethyl)amino]methyl]cycloheptan-1-ol
CID 62610620
2-[[ethyl(2-methylpropyl)amino]methyl]-N-methylcycloheptan-1-amine
CID 62614308
2-[[cyclopropylmethyl(propyl)amino]methyl]cyclopentan-1-ol
CID 62609054
2-[[2-hydroxyethyl(propan-2-yl)amino]methyl]cyclopentan-1-ol
CID 62610119
3-[4-(dimethylamino)butan-2-yl]-1-[(2-hydroxycyclohexyl)methyl]-1-methylurea
CID 110011987
2-[[ethyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 62609558
trans-(1R,2R)-2-[bis(2-methylpropyl)amino]cyclopentan-1-ol
CID 102734440

Frequently Asked Questions

What is the IUPAC name of 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol (CID 62609389) is 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol is CC(C)CN(CC(C)C)CC1CCCCC1O.
What is the InChIKey of 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is NZYQTFOVOBPQDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO/c1-12(2)9-16(10-13(3)4)11-14-7-5-6-8-15(14)17/h12-15,17H,5-11H2,1-4H3.
What are the key properties of 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol?
2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 241.42 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 62609389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).