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

C12H27NO — CID 62271469

IUPAC2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol
SMILESCCCC(C)(CO)CN(C)CC(C)C
InChIInChI=1S/C12H27NO/c1-6-7-12(4,10-14)9-13(5)8-11(2)3/h11,14H,6-10H2,1-5H3
InChIKeyCCHACRJLVVLCDH-UHFFFAOYSA-N
MW201.35 g/mol
LogP2.37
Rot. Bonds7

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

2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol (PubChem CID 62271469) has the molecular formula C12H27NO and a molecular weight of 201.35 g/mol. Its IUPAC name is 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol.

Molecular Properties

Compound Name2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol
PubChem CID62271469
Molecular FormulaC12H27NO
Molecular Weight201.35 g/mol
Exact Mass201.21
IUPAC Name2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol
SMILESCCCC(C)(CO)CN(C)CC(C)C
InChIInChI=1S/C12H27NO/c1-6-7-12(4,10-14)9-13(5)8-11(2)3/h11,14H,6-10H2,1-5H3
InChIKeyCCHACRJLVVLCDH-UHFFFAOYSA-N
XLogP2.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.35
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[methyl-[2-methyl-2-(methylaminomethyl)pentyl]amino]propan-2-ol
CID 62337356
1-[[2-(ethylaminomethyl)-2-methylpentyl]-methylamino]propan-2-ol
CID 62337553
N-tert-butyl-N',2-dimethyl-N'-(2-methylbutyl)-2-propylpropane-1,3-diamine
CID 55194829
2-methyl-3-[methyl(2-methylpropyl)amino]-2-(propan-2-ylamino)propan-1-ol
CID 64798699
2-methyl-N'-(2-methylpropyl)-N'-propan-2-yl-2-propylpropane-1,3-diamine
CID 62259708
2-[[(2-bromophenyl)methyl-methylamino]methyl]-2-methylpentan-1-ol
CID 55055281
2-[[1-hydroxypropan-2-yl(methyl)amino]methyl]-2-methylpropane-1,3-diol
CID 104553558
2-methyl-2-[2-(2-methylpropoxy)ethyl]pentan-1-ol
CID 106459431
2-methyl-5-[methyl(2-methylpropyl)amino]-2-(propylamino)pentan-1-ol
CID 64796336
2-methyl-N',N'-bis(3-methylbutyl)-2-propylpropane-1,3-diamine
CID 107871155
2-(chloromethyl)-2-methylpentan-1-ol
CID 55303877
2-methylpentane-2,4-diol;2-methyl-2-propylpropane-1,3-diol
CID 88709547

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol?
The IUPAC name of 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol (CID 62271469) is 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol.
What is the SMILES notation for 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol?
The canonical SMILES for 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol is CCCC(C)(CO)CN(C)CC(C)C.
What is the InChIKey of 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol?
The InChIKey is CCHACRJLVVLCDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO/c1-6-7-12(4,10-14)9-13(5)8-11(2)3/h11,14H,6-10H2,1-5H3.
What are the key properties of 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol?
2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol has a molecular weight of 201.35 g/mol, XLogP of 2.37, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[[methyl(2-methylpropyl)amino]methyl]pentan-1-ol is sourced from PubChem (CID 62271469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).