6-(aminomethyl)-8-chloro-1H-quinolin-2-one

C10H9ClN2O — CID 82507717

IUPAC6-(aminomethyl)-8-chloro-1H-quinolin-2-one
SMILESNCc1cc(Cl)c2[nH]c(=O)ccc2c1
InChIInChI=1S/C10H9ClN2O/c11-8-4-6(5-12)3-7-1-2-9(14)13-10(7)8/h1-4H,5,12H2,(H,13,14)
InChIKeyLRXFANYLJNSYKA-UHFFFAOYSA-N
MW208.65 g/mol
LogP1.64
Rot. Bonds1

About 6-(aminomethyl)-8-chloro-1H-quinolin-2-one

6-(aminomethyl)-8-chloro-1H-quinolin-2-one (PubChem CID 82507717) has the molecular formula C10H9ClN2O and a molecular weight of 208.65 g/mol. Its IUPAC name is 6-(aminomethyl)-8-chloro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(aminomethyl)-8-chloro-1H-quinolin-2-one
PubChem CID82507717
Molecular FormulaC10H9ClN2O
Molecular Weight208.65 g/mol
Exact Mass208.04
IUPAC Name6-(aminomethyl)-8-chloro-1H-quinolin-2-one
SMILESNCc1cc(Cl)c2[nH]c(=O)ccc2c1
InChIInChI=1S/C10H9ClN2O/c11-8-4-6(5-12)3-7-1-2-9(14)13-10(7)8/h1-4H,5,12H2,(H,13,14)
InChIKeyLRXFANYLJNSYKA-UHFFFAOYSA-N
XLogP1.64
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.65
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

8-bromo-6-chloro-1H-quinolin-2-one
CID 81272746
5-amino-8-chloro-6-methyl-1H-quinolin-2-one
CID 130017028
6-amino-8-(3-chloropropyl)-1H-quinolin-2-one
CID 118872250
6-(2-amino-1-hydroxyethyl)-8-hydroxy-1H-quinolin-2-one
CID 10421005
[6-(aminomethyl)naphthalen-2-yl]methanamine
CID 67748708
6,8-dibromo-1H-quinolin-2-one
CID 53399157
6-acetyl-8-ethyl-1H-quinolin-2-one
CID 82212904
6-bromo-8-ethyl-1H-quinolin-2-one
CID 81288840
4-(aminomethyl)-6-(3-chlorophenyl)-1H-pyridin-2-one
CID 105495501
1H-benzo[h]quinolin-2-one
CID 12539195
6-(2-aminoethyl)-4-chloro-1,3-dihydrobenzimidazol-2-one
CID 83885627
6-[(E)-but-2-enyl]-1H-quinolin-2-one
CID 119094880

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-8-chloro-1H-quinolin-2-one?
The IUPAC name of 6-(aminomethyl)-8-chloro-1H-quinolin-2-one (CID 82507717) is 6-(aminomethyl)-8-chloro-1H-quinolin-2-one.
What is the SMILES notation for 6-(aminomethyl)-8-chloro-1H-quinolin-2-one?
The canonical SMILES for 6-(aminomethyl)-8-chloro-1H-quinolin-2-one is NCc1cc(Cl)c2[nH]c(=O)ccc2c1.
What is the InChIKey of 6-(aminomethyl)-8-chloro-1H-quinolin-2-one?
The InChIKey is LRXFANYLJNSYKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O/c11-8-4-6(5-12)3-7-1-2-9(14)13-10(7)8/h1-4H,5,12H2,(H,13,14).
What are the key properties of 6-(aminomethyl)-8-chloro-1H-quinolin-2-one?
6-(aminomethyl)-8-chloro-1H-quinolin-2-one has a molecular weight of 208.65 g/mol, XLogP of 1.64, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-8-chloro-1H-quinolin-2-one is sourced from PubChem (CID 82507717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).