5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one

C15H22N2O2 — CID 81109019

IUPAC5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one
SMILESCOC1CCCC1NC1CCCc2[nH]c(=O)ccc21
InChIInChI=1S/C15H22N2O2/c1-19-14-7-3-6-13(14)16-11-4-2-5-12-10(11)8-9-15(18)17-12/h8-9,11,13-14,16H,2-7H2,1H3,(H,17,18)
InChIKeyCYDZXAXNXUISHP-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.91
Rot. Bonds3

About 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one

5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one (PubChem CID 81109019) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one.

Molecular Properties

Compound Name5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one
PubChem CID81109019
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one
SMILESCOC1CCCC1NC1CCCc2[nH]c(=O)ccc21
InChIInChI=1S/C15H22N2O2/c1-19-14-7-3-6-13(14)16-11-4-2-5-12-10(11)8-9-15(18)17-12/h8-9,11,13-14,16H,2-7H2,1H3,(H,17,18)
InChIKeyCYDZXAXNXUISHP-UHFFFAOYSA-N
XLogP1.91
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The IUPAC name of 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one (CID 81109019) is 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one.
What is the SMILES notation for 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The canonical SMILES for 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one is COC1CCCC1NC1CCCc2[nH]c(=O)ccc21.
What is the InChIKey of 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The InChIKey is CYDZXAXNXUISHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-19-14-7-3-6-13(14)16-11-4-2-5-12-10(11)8-9-15(18)17-12/h8-9,11,13-14,16H,2-7H2,1H3,(H,17,18).
What are the key properties of 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one?
5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one has a molecular weight of 262.35 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methoxycyclopentyl)amino]-5,6,7,8-tetrahydro-1H-quinolin-2-one is sourced from PubChem (CID 81109019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).