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

C10H24N2O — CID 104710922

IUPAC3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol
SMILESCC(C)CN(C(C)C)C(CN)CO
InChIInChI=1S/C10H24N2O/c1-8(2)6-12(9(3)4)10(5-11)7-13/h8-10,13H,5-7,11H2,1-4H3
InChIKeyPYJYTRRZQKXQBK-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.67
Rot. Bonds6

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

3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol (PubChem CID 104710922) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol.

Molecular Properties

Compound Name3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol
PubChem CID104710922
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol
SMILESCC(C)CN(C(C)C)C(CN)CO
InChIInChI=1S/C10H24N2O/c1-8(2)6-12(9(3)4)10(5-11)7-13/h8-10,13H,5-7,11H2,1-4H3
InChIKeyPYJYTRRZQKXQBK-UHFFFAOYSA-N
XLogP0.67
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 ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-2-[propan-2-yl(propyl)amino]propan-1-ol
CID 104710820
3-methoxy-2-N-(2-methylpropyl)-2-N-propan-2-ylpropane-1,2-diamine
CID 103226287
4-amino-N-methyl-3-[2-methylpropyl(propan-2-yl)amino]butanamide
CID 66429259
4-amino-N,N-diethyl-3-[2-methylpropyl(propan-2-yl)amino]butanamide
CID 66431686
tert-butyl N-[3-amino-2-[2-methylpropyl(propan-2-yl)amino]propyl]carbamate
CID 102729846
2-[aminomethyl(propan-2-yl)amino]propan-1-ol
CID 177367266
3-amino-2-[butan-2-yl(2-methoxyethyl)amino]propan-1-ol
CID 104710921
2-[amino(propan-2-yl)amino]propane-1,3-diol
CID 130198697
N-(2-methylpropyl)-N-propan-2-ylbutan-2-amine
CID 139772547
1-(5-methylfuran-2-yl)-N-(2-methylpropyl)-N-propan-2-ylethane-1,2-diamine
CID 55000956
4-amino-N,N-diethyl-3-[2-methylpropyl(pentan-3-yl)amino]butanamide
CID 79490448
1-cyclohexyl-N-(2-methylpropyl)-N-propan-2-ylethane-1,2-diamine
CID 55001154

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol?
The IUPAC name of 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol (CID 104710922) is 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol.
What is the SMILES notation for 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol?
The canonical SMILES for 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol is CC(C)CN(C(C)C)C(CN)CO.
What is the InChIKey of 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol?
The InChIKey is PYJYTRRZQKXQBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-8(2)6-12(9(3)4)10(5-11)7-13/h8-10,13H,5-7,11H2,1-4H3.
What are the key properties of 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol?
3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol has a molecular weight of 188.31 g/mol, XLogP of 0.67, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-[2-methylpropyl(propan-2-yl)amino]propan-1-ol is sourced from PubChem (CID 104710922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).