1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol

C14H21NO3 — CID 43090645

IUPAC1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol
SMILESCOc1cccc(COCC(O)CNC2CC2)c1
InChIInChI=1S/C14H21NO3/c1-17-14-4-2-3-11(7-14)9-18-10-13(16)8-15-12-5-6-12/h2-4,7,12-13,15-16H,5-6,8-10H2,1H3
InChIKeyDIFHACNINMYFKM-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.32
Rot. Bonds8

About 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol

1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol (PubChem CID 43090645) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol
PubChem CID43090645
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol
SMILESCOc1cccc(COCC(O)CNC2CC2)c1
InChIInChI=1S/C14H21NO3/c1-17-14-4-2-3-11(7-14)9-18-10-13(16)8-15-12-5-6-12/h2-4,7,12-13,15-16H,5-6,8-10H2,1H3
InChIKeyDIFHACNINMYFKM-UHFFFAOYSA-N
XLogP1.32
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-adamantylmethylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol
CID 4801616
1-[(3,4-dimethylcyclohexyl)amino]-3-phenylmethoxypropan-2-ol
CID 64742870
N-[(3-methoxyphenyl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 62707677
N-[2-[(3-methoxyphenyl)methoxy]ethyl]cyclohexanamine
CID 62565943
N-[[3-[(3-methoxyphenyl)methoxymethyl]furan-2-yl]methyl]cyclopropanamine
CID 62440737
(2S)-1-[benzyl-[(3-methoxyphenyl)methyl]amino]-3-phenylmethoxypropan-2-ol
CID 93162067
1-(2,2-difluoroethoxymethyl)-3-methoxybenzene
CID 88878889
methyl 3-[(3-methoxyphenyl)methoxy]-2-methylpropanoate
CID 43537941
4-[(3-methoxyphenyl)methylamino]cyclohexane-1-carboxylic acid
CID 60809214
1-[(1-methylpyrrolidin-3-yl)amino]-3-phenylmethoxypropan-2-ol
CID 61462412
1-[(2-chlorophenyl)methoxy]-3-(cyclopropylamino)propan-2-ol
CID 43090643
1-[(4-chlorophenyl)methoxy]-3-(cyclopentylamino)propan-2-ol
CID 60635580

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol?
The IUPAC name of 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol (CID 43090645) is 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol.
What is the SMILES notation for 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol?
The canonical SMILES for 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol is COc1cccc(COCC(O)CNC2CC2)c1.
What is the InChIKey of 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol?
The InChIKey is DIFHACNINMYFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-17-14-4-2-3-11(7-14)9-18-10-13(16)8-15-12-5-6-12/h2-4,7,12-13,15-16H,5-6,8-10H2,1H3.
What are the key properties of 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol?
1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol has a molecular weight of 251.33 g/mol, XLogP of 1.32, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-[(3-methoxyphenyl)methoxy]propan-2-ol is sourced from PubChem (CID 43090645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).