2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol

C10H23NO — CID 115250601

IUPAC2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol
SMILESCCC(CO)CN(C)CC(C)C
InChIInChI=1S/C10H23NO/c1-5-10(8-12)7-11(4)6-9(2)3/h9-10,12H,5-8H2,1-4H3
InChIKeyOGBHTVLMMRJGRF-UHFFFAOYSA-N
MW173.30 g/mol
LogP1.59
Rot. Bonds6

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

2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol (PubChem CID 115250601) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol.

Molecular Properties

Compound Name2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol
PubChem CID115250601
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol
SMILESCCC(CO)CN(C)CC(C)C
InChIInChI=1S/C10H23NO/c1-5-10(8-12)7-11(4)6-9(2)3/h9-10,12H,5-8H2,1-4H3
InChIKeyOGBHTVLMMRJGRF-UHFFFAOYSA-N
XLogP1.59
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[methyl-[(2,4,6-trimethylphenyl)methyl]amino]methyl]butan-1-ol
CID 115250899
2-[[tert-butyl(methyl)amino]methyl]butan-1-ol
CID 115250602
2-[[(4-tert-butylphenyl)methyl-methylamino]methyl]butan-1-ol
CID 115250873
2-[[methyl-[2-(2-methylphenyl)ethyl]amino]methyl]butan-1-ol
CID 115251113
2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]butan-1-ol
CID 115250928
2-(methylamino)-3-[methyl(2-methylpropyl)amino]propan-1-ol
CID 64797210
2-[[(3,4-difluorophenyl)methyl-methylamino]methyl]butan-1-ol
CID 115250906
2-[[(5-bromo-2-fluorophenyl)methyl-methylamino]methyl]butan-1-ol
CID 115250941
2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]butan-1-ol
CID 115251118
2-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]butan-1-ol
CID 115250884
ethane;N-ethyl-N,2-dimethylpropan-1-amine
CID 143400672
2-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]butan-1-ol
CID 115250966

Frequently Asked Questions

What is the IUPAC name of 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol?
The IUPAC name of 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol (CID 115250601) is 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol.
What is the SMILES notation for 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol?
The canonical SMILES for 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol is CCC(CO)CN(C)CC(C)C.
What is the InChIKey of 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol?
The InChIKey is OGBHTVLMMRJGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-10(8-12)7-11(4)6-9(2)3/h9-10,12H,5-8H2,1-4H3.
What are the key properties of 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol?
2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol has a molecular weight of 173.30 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[methyl(2-methylpropyl)amino]methyl]butan-1-ol is sourced from PubChem (CID 115250601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).