1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol

C10H24N2O — CID 64819539

IUPAC1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol
SMILESCCCC(C)N(C)CC(C)(O)CN
InChIInChI=1S/C10H24N2O/c1-5-6-9(2)12(4)8-10(3,13)7-11/h9,13H,5-8,11H2,1-4H3
InChIKeyUDEPCWYAZPVXLJ-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.82
Rot. Bonds6

About 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol

1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol (PubChem CID 64819539) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol.

Molecular Properties

Compound Name1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol
PubChem CID64819539
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol
SMILESCCCC(C)N(C)CC(C)(O)CN
InChIInChI=1S/C10H24N2O/c1-5-6-9(2)12(4)8-10(3,13)7-11/h9,13H,5-8,11H2,1-4H3
InChIKeyUDEPCWYAZPVXLJ-UHFFFAOYSA-N
XLogP0.82
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-Aminopiperidin-1-yl)-2-methylpropan-2-ol dihydrochloride
CID 71758734
1-(4-Aminopiperidin-1-yl)-2-methylpropan-2-ol
CID 50986512
1-Amino-3-(dimethylamino)-2-methylpropan-2-ol
CID 64820313
1-[(3S,4R)-4-amino-3-fluoropiperidin-1-yl]-2-methylpropan-2-ol
CID 170631329
2-Methyl-1-(pentan-3-ylamino)propan-2-ol
CID 277593
1-Amino-2-methyl-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]propan-2-ol
CID 64820229
1-[(4-Amino-1,1,1-trifluorobutan-2-yl)-ethylamino]-2-methylpropan-2-ol
CID 79381742
1-[(4-Amino-1,1,1-trifluorobutan-2-yl)-methylamino]-2-methylpropan-2-ol
CID 79381866
2-Methyl-1-[4-(propan-2-ylamino)piperidin-1-yl]propan-2-ol
CID 56787366
1-[3-(Dimethylamino)propylamino]-2-methylpropan-2-ol
CID 39236552
2-Methyl-1-{[1-(propan-2-yl)piperidin-4-yl]amino}propan-2-ol
CID 59363487
2-Methyl-1-[methyl(piperidin-4-yl)amino]propan-2-ol
CID 60883813

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol?
The IUPAC name of 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol (CID 64819539) is 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol.
What is the SMILES notation for 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol?
The canonical SMILES for 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol is CCCC(C)N(C)CC(C)(O)CN.
What is the InChIKey of 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol?
The InChIKey is UDEPCWYAZPVXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-5-6-9(2)12(4)8-10(3,13)7-11/h9,13H,5-8,11H2,1-4H3.
What are the key properties of 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol?
1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol has a molecular weight of 188.31 g/mol, XLogP of 0.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-methyl-3-[methyl(pentan-2-yl)amino]propan-2-ol is sourced from PubChem (CID 64819539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).