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

C10H24N2O — CID 43269476

IUPAC1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol
SMILESCCCN(CC(O)CNC)C(C)C
InChIInChI=1S/C10H24N2O/c1-5-6-12(9(2)3)8-10(13)7-11-4/h9-11,13H,5-8H2,1-4H3
InChIKeyWGZISXMNOAGTNA-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.69
Rot. Bonds7

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

1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol (PubChem CID 43269476) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol
PubChem CID43269476
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol
SMILESCCCN(CC(O)CNC)C(C)C
InChIInChI=1S/C10H24N2O/c1-5-6-12(9(2)3)8-10(13)7-11-4/h9-11,13H,5-8H2,1-4H3
InChIKeyWGZISXMNOAGTNA-UHFFFAOYSA-N
XLogP0.69
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-1-[propan-2-yl(propyl)amino]propan-2-ol
CID 103934934
1-[1-(dimethylamino)propan-2-yl-ethylamino]-3-(methylamino)propan-2-ol
CID 103188299
1-(methylamino)-3-[methyl(pentan-2-yl)amino]propan-2-ol
CID 43571982
1-(dimethylamino)-3-(methylamino)propan-2-ol
CID 12700841
1-(methylamino)-3-[methyl(3-methylbutyl)amino]propan-2-ol
CID 61429791
(2R)-1-N-propan-2-yl-1-N-propylpropane-1,2-diamine
CID 103934466
N-tert-butyl-2-methyl-N'-propan-2-yl-N'-propylpropane-1,3-diamine
CID 62422187
1-bromo-3-[pentyl(propan-2-yl)amino]propan-2-ol
CID 112561467
1-chloro-3-[pentyl(propan-2-yl)amino]propan-2-ol
CID 112561466
1-(methylamino)butan-2-ol;hydrate
CID 173049330
1-[bis(2-methoxyethyl)amino]-3-(methylamino)propan-2-ol
CID 61418429
3-amino-4-[propan-2-yl(propyl)amino]butan-1-ol
CID 64900510

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol?
The IUPAC name of 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol (CID 43269476) is 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol.
What is the SMILES notation for 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol?
The canonical SMILES for 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol is CCCN(CC(O)CNC)C(C)C.
What is the InChIKey of 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol?
The InChIKey is WGZISXMNOAGTNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-5-6-12(9(2)3)8-10(13)7-11-4/h9-11,13H,5-8H2,1-4H3.
What are the key properties of 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol?
1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol has a molecular weight of 188.31 g/mol, XLogP of 0.69, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)-3-[propan-2-yl(propyl)amino]propan-2-ol is sourced from PubChem (CID 43269476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).