2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol

C13H27NO — CID 62608844

IUPAC2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol
SMILESCCCC(C)N(C)CC1CCCCC1O
InChIInChI=1S/C13H27NO/c1-4-7-11(2)14(3)10-12-8-5-6-9-13(12)15/h11-13,15H,4-10H2,1-3H3
InChIKeyFAAHMHNLTZAJPS-UHFFFAOYSA-N
MW213.37 g/mol
LogP2.66
Rot. Bonds5

About 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol

2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 62608844) has the molecular formula C13H27NO and a molecular weight of 213.37 g/mol. Its IUPAC name is 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol
PubChem CID62608844
Molecular FormulaC13H27NO
Molecular Weight213.37 g/mol
Exact Mass213.21
IUPAC Name2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol
SMILESCCCC(C)N(C)CC1CCCCC1O
InChIInChI=1S/C13H27NO/c1-4-7-11(2)14(3)10-12-8-5-6-9-13(12)15/h11-13,15H,4-10H2,1-3H3
InChIKeyFAAHMHNLTZAJPS-UHFFFAOYSA-N
XLogP2.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.37
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[butan-2-yl(methyl)amino]methyl]cycloheptan-1-ol
CID 62611279
trans-(1S,2S)-2-[methyl(pentan-2-yl)amino]cyclohexan-1-ol
CID 102731911
2-[[bis(2-methylpropyl)amino]methyl]cyclohexan-1-ol
CID 62609389
2-[(pentan-2-ylamino)methyl]cyclohexan-1-ol
CID 64927417
N-ethyl-2,2-dimethyl-6-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-amine
CID 79853183
2-[[cyclopropyl(methyl)amino]methyl]cycloheptan-1-ol
CID 62609891
(1R)-2-propylcyclohexan-1-ol
CID 144627240
4-methyl-2-[[methyl(4-methylpentan-2-yl)amino]methyl]cyclohexan-1-ol
CID 62610991
2-[[methyl-[(2-methylcyclopropyl)methyl]amino]methyl]cyclopentan-1-ol
CID 63866134
2-[[methyl-(4-methylcyclohexyl)amino]methyl]cycloheptan-1-ol
CID 62611154
2-[[3-ethylsulfanylpropyl(methyl)amino]methyl]cyclohexan-1-ol
CID 115968519
1-(4-ethylpiperazin-1-yl)-2-[(2-hydroxycyclopentyl)methyl-methylamino]propan-1-one
CID 109397804

Frequently Asked Questions

What is the IUPAC name of 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol (CID 62608844) is 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol is CCCC(C)N(C)CC1CCCCC1O.
What is the InChIKey of 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is FAAHMHNLTZAJPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-4-7-11(2)14(3)10-12-8-5-6-9-13(12)15/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol?
2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol has a molecular weight of 213.37 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[methyl(pentan-2-yl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 62608844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).