4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol

C10H23NO2 — CID 115679518

IUPAC4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol
SMILESCOCC(C)(C)NCCC(C)(C)O
InChIInChI=1S/C10H23NO2/c1-9(2,8-13-5)11-7-6-10(3,4)12/h11-12H,6-8H2,1-5H3
InChIKeyGPKUHDWKMWFFBL-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.16
Rot. Bonds6

About 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol

4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol (PubChem CID 115679518) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol.

Molecular Properties

Compound Name4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol
PubChem CID115679518
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol
SMILESCOCC(C)(C)NCCC(C)(C)O
InChIInChI=1S/C10H23NO2/c1-9(2,8-13-5)11-7-6-10(3,4)12/h11-12H,6-8H2,1-5H3
InChIKeyGPKUHDWKMWFFBL-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-N-(2-methoxyethyl)-2-methylpropan-2-amine
CID 115609446
N-(1-methoxy-2-methylpropan-2-yl)hexan-1-amine
CID 115644983
1-methoxy-2-methyl-N-[2-[(2-methylpropan-2-yl)oxy]ethyl]propan-2-amine
CID 115609397
2-[2-[(1-methoxy-2-methylpropan-2-yl)amino]ethoxy]ethanol
CID 115643011
ethane;N-ethyl-1-methoxy-2-methylpropan-2-amine
CID 177317291
N-(2-ethylsulfanylethyl)-1-methoxy-2-methylpropan-2-amine
CID 115648465
N-(2-tert-butylsulfonylethyl)-1-methoxy-2-methylpropan-2-amine
CID 103713921
1-methoxy-N-[2-(3-methoxypropoxy)ethyl]-2-methylpropan-2-amine
CID 103179461
2-(hydroxymethyl)-2-[(3-hydroxy-3-methylbutyl)amino]propane-1,3-diol
CID 107852406
1-methoxy-2-methyl-N-(2-pyrrolidin-1-ylethyl)propan-2-amine
CID 103864713
2-[(3-hydroxy-3-methylbutyl)amino]-2-methylpentanoic acid
CID 79355808
N-(1-methoxy-2-methylpropan-2-yl)-2-methylpentan-1-amine
CID 115906085

Frequently Asked Questions

What is the IUPAC name of 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol?
The IUPAC name of 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol (CID 115679518) is 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol.
What is the SMILES notation for 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol?
The canonical SMILES for 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol is COCC(C)(C)NCCC(C)(C)O.
What is the InChIKey of 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol?
The InChIKey is GPKUHDWKMWFFBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-9(2,8-13-5)11-7-6-10(3,4)12/h11-12H,6-8H2,1-5H3.
What are the key properties of 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol?
4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol has a molecular weight of 189.30 g/mol, XLogP of 1.16, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methoxy-2-methylpropan-2-yl)amino]-2-methylbutan-2-ol is sourced from PubChem (CID 115679518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).