1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol

C11H25NO2 — CID 175894515

IUPAC1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol
SMILESCCCN(CC(C)(C)O)CC(C)(C)O
InChIInChI=1S/C11H25NO2/c1-6-7-12(8-10(2,3)13)9-11(4,5)14/h13-14H,6-9H2,1-5H3
InChIKeyBQRVGJXYCBHDNW-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.24
Rot. Bonds6

About 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol

1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol (PubChem CID 175894515) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol
PubChem CID175894515
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC Name1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol
SMILESCCCN(CC(C)(C)O)CC(C)(C)O
InChIInChI=1S/C11H25NO2/c1-6-7-12(8-10(2,3)13)9-11(4,5)14/h13-14H,6-9H2,1-5H3
InChIKeyBQRVGJXYCBHDNW-UHFFFAOYSA-N
XLogP1.24
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[butyl-(2-hydroxy-2-methylpropyl)amino]-2-methylpropan-2-ol
CID 90370489
1-[amino(propyl)amino]-2-methylpropan-2-ol
CID 166987679
1-[dodecyl(ethyl)amino]-2-methylpropan-2-ol
CID 79390324
1-(dipropylamino)-2-methylpentan-2-ol
CID 106291211
1-amino-3-(dipropylamino)-2-methylpropan-2-ol
CID 64819638
1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol
CID 79006123
2-methyl-1-[(5-methylthiophen-2-yl)methyl-propylamino]propan-2-ol
CID 24714219
1-[ethyl(propyl)amino]-2,3-dimethylbutan-2-ol
CID 114448900
1-(dimethylamino)-2-methylpropan-2-ol;ethane
CID 162022408
5-[ethyl-(2-hydroxy-2-methylpropyl)amino]pentan-1-ol
CID 79047122
1-[ethyl(2-ethylsulfanylethyl)amino]-2-methylpropan-2-ol
CID 111462033
1-[9-bromononyl(ethyl)amino]-2-methylpropan-2-ol
CID 105343823

Frequently Asked Questions

What is the IUPAC name of 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol?
The IUPAC name of 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol (CID 175894515) is 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol?
The canonical SMILES for 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol is CCCN(CC(C)(C)O)CC(C)(C)O.
What is the InChIKey of 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol?
The InChIKey is BQRVGJXYCBHDNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-6-7-12(8-10(2,3)13)9-11(4,5)14/h13-14H,6-9H2,1-5H3.
What are the key properties of 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol?
1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol has a molecular weight of 203.33 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-hydroxy-2-methylpropyl)-propylamino]-2-methylpropan-2-ol is sourced from PubChem (CID 175894515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).