1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol

C16H25NO2 — CID 65105268

IUPAC1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol
SMILESCOc1ccccc1CC(C)NCC1(O)CCCC1
InChIInChI=1S/C16H25NO2/c1-13(17-12-16(18)9-5-6-10-16)11-14-7-3-4-8-15(14)19-2/h3-4,7-8,13,17-18H,5-6,9-12H2,1-2H3
InChIKeyWAXMZHCKGRRNFP-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.52
Rot. Bonds6

About 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol

1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol (PubChem CID 65105268) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol
PubChem CID65105268
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol
SMILESCOc1ccccc1CC(C)NCC1(O)CCCC1
InChIInChI=1S/C16H25NO2/c1-13(17-12-16(18)9-5-6-10-16)11-14-7-3-4-8-15(14)19-2/h3-4,7-8,13,17-18H,5-6,9-12H2,1-2H3
InChIKeyWAXMZHCKGRRNFP-UHFFFAOYSA-N
XLogP2.52
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1-hydroxycyclobutyl)methyl]-3-[1-(2-methoxyphenyl)-3-methylbutan-2-yl]urea
CID 111631492
2-[1-(2-methoxyphenyl)propan-2-ylamino]ethanol
CID 18627851
1-[[4-(2-propoxyphenyl)butan-2-ylamino]methyl]cyclohexan-1-ol
CID 175883460
1-[[1-(2-methoxyphenyl)propylamino]methyl]cyclobutan-1-ol
CID 115692774
N-(2-fluoroethyl)-1-(2-methoxyphenyl)propan-2-amine
CID 110174086
1-[[1-(4-fluorophenyl)propan-2-ylamino]methyl]cyclohexan-1-ol
CID 55152835
N-[[1-[(2-methoxyphenyl)methyl]cyclohexyl]methyl]propan-2-amine
CID 62724376
N-[1-(2-methoxyphenyl)propan-2-yl]pentan-1-amine
CID 43757590
N-[1-(aminomethyl)cyclopentyl]-4-(2-methoxyphenyl)-3-methylbutanamide;hydrochloride
CID 119565114
N-[1-(2-methoxyphenyl)propan-2-yl]-2,2-dimethylcyclopentan-1-amine
CID 79859791
1-[(2-methoxyanilino)methyl]cyclobutan-1-ol
CID 131701666
1-[(1-methoxypropan-2-ylamino)methyl]cyclopentan-1-ol
CID 65107675

Frequently Asked Questions

What is the IUPAC name of 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol (CID 65105268) is 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol is COc1ccccc1CC(C)NCC1(O)CCCC1.
What is the InChIKey of 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol?
The InChIKey is WAXMZHCKGRRNFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-13(17-12-16(18)9-5-6-10-16)11-14-7-3-4-8-15(14)19-2/h3-4,7-8,13,17-18H,5-6,9-12H2,1-2H3.
What are the key properties of 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol?
1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol has a molecular weight of 263.38 g/mol, XLogP of 2.52, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(2-methoxyphenyl)propan-2-ylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65105268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).