[1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol

C17H21NO2 — CID 79646293

IUPAC[1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol
SMILESCNC1(CO)CCC(Oc2ccc3ccccc3c2)C1
InChIInChI=1S/C17H21NO2/c1-18-17(12-19)9-8-16(11-17)20-15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10,16,18-19H,8-9,11-12H2,1H3
InChIKeyRNENEPYJVHCSAF-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.72
Rot. Bonds4

About [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol

[1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol (PubChem CID 79646293) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol
PubChem CID79646293
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name[1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol
SMILESCNC1(CO)CCC(Oc2ccc3ccccc3c2)C1
InChIInChI=1S/C17H21NO2/c1-18-17(12-19)9-8-16(11-17)20-15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10,16,18-19H,8-9,11-12H2,1H3
InChIKeyRNENEPYJVHCSAF-UHFFFAOYSA-N
XLogP2.72
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol?
The IUPAC name of [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol (CID 79646293) is [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol.
What is the SMILES notation for [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol?
The canonical SMILES for [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol is CNC1(CO)CCC(Oc2ccc3ccccc3c2)C1.
What is the InChIKey of [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol?
The InChIKey is RNENEPYJVHCSAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-18-17(12-19)9-8-16(11-17)20-15-7-6-13-4-2-3-5-14(13)10-15/h2-7,10,16,18-19H,8-9,11-12H2,1H3.
What are the key properties of [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol?
[1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol has a molecular weight of 271.36 g/mol, XLogP of 2.72, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-3-naphthalen-2-yloxycyclopentyl]methanol is sourced from PubChem (CID 79646293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).