2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol

C16H32N2O3 — CID 64825994

IUPAC2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol
SMILESCOCCN(CC(CO)(NC1CC1)C1CC1)C(C)COC
InChIInChI=1S/C16H32N2O3/c1-13(10-21-3)18(8-9-20-2)11-16(12-19,14-4-5-14)17-15-6-7-15/h13-15,17,19H,4-12H2,1-3H3
InChIKeyJZHUJOIHFZNLOO-UHFFFAOYSA-N
MW300.44 g/mol
LogP0.86
Rot. Bonds12

About 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol

2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol (PubChem CID 64825994) has the molecular formula C16H32N2O3 and a molecular weight of 300.44 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol
PubChem CID64825994
Molecular FormulaC16H32N2O3
Molecular Weight300.44 g/mol
Exact Mass300.24
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol
SMILESCOCCN(CC(CO)(NC1CC1)C1CC1)C(C)COC
InChIInChI=1S/C16H32N2O3/c1-13(10-21-3)18(8-9-20-2)11-16(12-19,14-4-5-14)17-15-6-7-15/h13-15,17,19H,4-12H2,1-3H3
InChIKeyJZHUJOIHFZNLOO-UHFFFAOYSA-N
XLogP0.86
TPSA53.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.44
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclopropyl-2-(cyclopropylamino)-3-[1-cyclopropylethyl(2-methoxyethyl)amino]propan-1-ol
CID 64826170
3-[butan-2-yl(2-methoxyethyl)amino]-2-cyclopropyl-2-(methylamino)propan-1-ol
CID 64825382
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propan-2-yl)amino]propan-1-ol
CID 64798076
2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propanenitrile
CID 63912492
2-(cyclopropylamino)-3-[ethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-1-ol
CID 64828099
2-cyclopropyl-2-(cyclopropylamino)-3-[2-ethoxyethyl(methyl)amino]propan-1-ol
CID 81065079
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol
CID 64796814
2-cyclopropyl-2-(cyclopropylamino)-3-(dibutylamino)propan-1-ol
CID 64796552
3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-2,2-dimethylpropan-1-ol
CID 62266357
2-(cyclopropylamino)-4-[2-methoxyethyl(pentan-3-yl)amino]-2-methylbutan-1-ol
CID 64825611
2-cyclopropyl-2-(cyclopropylamino)-3-propan-2-yloxypropan-1-ol
CID 64804667
2-cyclopropyl-3-[2-methoxyethyl(methyl)amino]-2-(propylamino)propan-1-ol
CID 64826993

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol (CID 64825994) is 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol is COCCN(CC(CO)(NC1CC1)C1CC1)C(C)COC.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol?
The InChIKey is JZHUJOIHFZNLOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O3/c1-13(10-21-3)18(8-9-20-2)11-16(12-19,14-4-5-14)17-15-6-7-15/h13-15,17,19H,4-12H2,1-3H3.
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol?
2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol has a molecular weight of 300.44 g/mol, XLogP of 0.86, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-1-ol is sourced from PubChem (CID 64825994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).