1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol

C13H19NO2 — CID 62773017

IUPAC1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol
SMILESCOc1ccc(C(C)(O)CNC2CC2)cc1
InChIInChI=1S/C13H19NO2/c1-13(15,9-14-11-5-6-11)10-3-7-12(16-2)8-4-10/h3-4,7-8,11,14-15H,5-6,9H2,1-2H3
InChIKeyGHHPZINVYUPYHJ-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.65
Rot. Bonds5

About 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol

1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol (PubChem CID 62773017) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol.

Molecular Properties

Compound Name1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol
PubChem CID62773017
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol
SMILESCOc1ccc(C(C)(O)CNC2CC2)cc1
InChIInChI=1S/C13H19NO2/c1-13(15,9-14-11-5-6-11)10-3-7-12(16-2)8-4-10/h3-4,7-8,11,14-15H,5-6,9H2,1-2H3
InChIKeyGHHPZINVYUPYHJ-UHFFFAOYSA-N
XLogP1.65
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopentylamino)-2-(4-methoxyphenyl)propan-2-ol
CID 115002997
1-(cyclopropylamino)-3-(4-methoxyphenyl)-2-methylpropan-2-ol
CID 63270705
2-(4-chloro-3-methoxyphenyl)-1-(cyclopropylamino)propan-2-ol
CID 79697533
2-(4-cyclobutylphenyl)-1-(cyclopropylamino)propan-2-ol
CID 116507021
N'-cyclopropyl-N-[2-(4-methoxyphenyl)-2-methylpropyl]ethane-1,2-diamine
CID 115207173
2-(4-methoxyphenyl)butan-2-ol
CID 10307904
4-cyclopentyl-2-(4-methoxyphenyl)butan-2-ol
CID 114191696
1-(cyclopropylamino)-2-[4-fluoro-3-(trifluoromethyl)phenyl]propan-2-ol
CID 107290618
1-(cyclopropylamino)-2-(9H-fluoren-2-yl)propan-2-ol
CID 62775351
1-(cyclopropylamino)-2-(3-fluoro-5-methylphenyl)propan-2-ol
CID 79704774
1-[(3-methoxycyclobutyl)amino]-2-phenylpropan-2-ol
CID 104589300
N-[2-(3,4-dimethoxyphenyl)-2-methylpropyl]cyclopropanamine
CID 62595328

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol?
The IUPAC name of 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol (CID 62773017) is 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol.
What is the SMILES notation for 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol?
The canonical SMILES for 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol is COc1ccc(C(C)(O)CNC2CC2)cc1.
What is the InChIKey of 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol?
The InChIKey is GHHPZINVYUPYHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-13(15,9-14-11-5-6-11)10-3-7-12(16-2)8-4-10/h3-4,7-8,11,14-15H,5-6,9H2,1-2H3.
What are the key properties of 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol?
1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol has a molecular weight of 221.30 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-2-(4-methoxyphenyl)propan-2-ol is sourced from PubChem (CID 62773017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).