2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol

C17H27NO3 — CID 103491096

IUPAC2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol
SMILESCCOCC(C)OCC(CO)(NC1CC1)c1ccccc1
InChIInChI=1S/C17H27NO3/c1-3-20-11-14(2)21-13-17(12-19,18-16-9-10-16)15-7-5-4-6-8-15/h4-8,14,16,18-19H,3,9-13H2,1-2H3
InChIKeyYYVCCLPXSWHKGW-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.07
Rot. Bonds10

About 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol

2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol (PubChem CID 103491096) has the molecular formula C17H27NO3 and a molecular weight of 293.41 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol
PubChem CID103491096
Molecular FormulaC17H27NO3
Molecular Weight293.41 g/mol
Exact Mass293.20
IUPAC Name2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol
SMILESCCOCC(C)OCC(CO)(NC1CC1)c1ccccc1
InChIInChI=1S/C17H27NO3/c1-3-20-11-14(2)21-13-17(12-19,18-16-9-10-16)15-7-5-4-6-8-15/h4-8,14,16,18-19H,3,9-13H2,1-2H3
InChIKeyYYVCCLPXSWHKGW-UHFFFAOYSA-N
XLogP2.07
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropanenitrile
CID 103489758
2-(cyclopropylamino)-4-(1-methoxypropan-2-yloxy)-2-phenylbutan-1-ol
CID 116695403
2-(ethylamino)-3-(1-methoxypropan-2-yloxy)-2-phenylpropan-1-ol
CID 64811608
2-(cyclopropylamino)-4-(3-methylbutan-2-yloxy)-2-phenylbutan-1-ol
CID 116695566
3-cyclobutyloxy-2-(cyclopropylamino)-2-phenylpropan-1-ol
CID 64809912
2-(ethylamino)-3-(4-methylpentan-2-yloxy)-2-phenylpropan-1-ol
CID 64802794
3-tert-butylsulfanyl-2-(cyclopropylamino)-2-phenylpropan-1-ol
CID 64820406
2-(cyclopropylamino)-4-[methyl(2-methylpropyl)amino]-2-phenylbutan-1-ol
CID 116695088
2-(cyclopropylamino)-4-[cyclopropyl(ethyl)amino]-2-phenylbutan-1-ol
CID 116695124
4-ethoxy-2-phenyl-2-(propan-2-ylamino)butan-1-ol
CID 116694277
2-(cyclopropylamino)-3-ethoxy-2-methylpropan-1-ol
CID 64803244
2-(cyclopropylmethylamino)-2-phenylbutan-1-ol
CID 61054828

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol (CID 103491096) is 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol is CCOCC(C)OCC(CO)(NC1CC1)c1ccccc1.
What is the InChIKey of 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol?
The InChIKey is YYVCCLPXSWHKGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO3/c1-3-20-11-14(2)21-13-17(12-19,18-16-9-10-16)15-7-5-4-6-8-15/h4-8,14,16,18-19H,3,9-13H2,1-2H3.
What are the key properties of 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol?
2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol has a molecular weight of 293.41 g/mol, XLogP of 2.07, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-(1-ethoxypropan-2-yloxy)-2-phenylpropan-1-ol is sourced from PubChem (CID 103491096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).