1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol

C14H28N2O — CID 78974043

IUPAC1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol
SMILESCC(C)CCN(CC(O)CNC1CC1)C1CC1
InChIInChI=1S/C14H28N2O/c1-11(2)7-8-16(13-5-6-13)10-14(17)9-15-12-3-4-12/h11-15,17H,3-10H2,1-2H3
InChIKeyJHBCZUVIIULFGU-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.61
Rot. Bonds9

About 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol

1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol (PubChem CID 78974043) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol
PubChem CID78974043
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol
SMILESCC(C)CCN(CC(O)CNC1CC1)C1CC1
InChIInChI=1S/C14H28N2O/c1-11(2)7-8-16(13-5-6-13)10-14(17)9-15-12-3-4-12/h11-15,17H,3-10H2,1-2H3
InChIKeyJHBCZUVIIULFGU-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylamino)-3-[methyl(2-methylpropyl)amino]propan-2-ol
CID 43272018
1-cyclopentyl-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol
CID 103159907
3-[cyclopentyl(3-methylbutyl)amino]propane-1,2-diol
CID 82850075
N,N'-dicyclopropyl-N'-(3-methylbutyl)pentane-1,5-diamine
CID 78989930
N,N'-dicyclopropyl-2-methyl-N'-(2-methylpropyl)propane-1,3-diamine
CID 62429720
1-(cyclopropylamino)-3-[methyl(pentan-2-yl)amino]propan-2-ol
CID 43571980
N-cyclohexyl-N'-cyclopropyl-N'-(3-methylbutyl)ethane-1,2-diamine
CID 78991088
1-(cyclopropylamino)-3-[2-(dimethylamino)ethyl-methylamino]propan-2-ol
CID 63695532
1-(cyclopropylamino)-3-[1-cyclopropylethyl(methyl)amino]propan-2-ol
CID 43569026
1-N-ethyl-3-N,3-N-bis(3-methylbutyl)cyclopentane-1,3-diamine
CID 107869628
N-cyclohexyl-N'-cyclopropyl-N'-(3-methylbutyl)propane-1,3-diamine
CID 78991158
1-(cyclopropylamino)-3-[cyclopropyl(furan-2-ylmethyl)amino]propan-2-ol
CID 55003773

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol?
The IUPAC name of 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol (CID 78974043) is 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol.
What is the SMILES notation for 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol?
The canonical SMILES for 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol is CC(C)CCN(CC(O)CNC1CC1)C1CC1.
What is the InChIKey of 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol?
The InChIKey is JHBCZUVIIULFGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11(2)7-8-16(13-5-6-13)10-14(17)9-15-12-3-4-12/h11-15,17H,3-10H2,1-2H3.
What are the key properties of 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol?
1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-[cyclopropyl(3-methylbutyl)amino]propan-2-ol is sourced from PubChem (CID 78974043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).