2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide

C14H14ClN3O — CID 116784065

IUPAC2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide
SMILESO=C(CNc1ccc(Cl)c2cccnc12)NC1CC1
InChIInChI=1S/C14H14ClN3O/c15-11-5-6-12(14-10(11)2-1-7-16-14)17-8-13(19)18-9-3-4-9/h1-2,5-7,9,17H,3-4,8H2,(H,18,19)
InChIKeyORYCSZJZDHLJPE-UHFFFAOYSA-N
MW275.74 g/mol
LogP2.58
Rot. Bonds4

About 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide

2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide (PubChem CID 116784065) has the molecular formula C14H14ClN3O and a molecular weight of 275.74 g/mol. Its IUPAC name is 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide
PubChem CID116784065
Molecular FormulaC14H14ClN3O
Molecular Weight275.74 g/mol
Exact Mass275.08
IUPAC Name2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide
SMILESO=C(CNc1ccc(Cl)c2cccnc12)NC1CC1
InChIInChI=1S/C14H14ClN3O/c15-11-5-6-12(14-10(11)2-1-7-16-14)17-8-13(19)18-9-3-4-9/h1-2,5-7,9,17H,3-4,8H2,(H,18,19)
InChIKeyORYCSZJZDHLJPE-UHFFFAOYSA-N
XLogP2.58
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-chloroquinolin-8-yl)amino]acetic acid
CID 116783965
1-(5-chloroquinolin-8-yl)-3-cyclopentylurea
CID 47201915
N-butan-2-yl-2-[(5-chloroquinolin-8-yl)amino]acetamide
CID 116783982
2-[(5-chloroquinolin-8-yl)amino]-1-morpholin-4-ylethanone
CID 116783960
2-[4-[(5-chloroquinolin-8-yl)methyl]piperazin-1-yl]-N-cyclopropylacetamide
CID 55827715
2-[[(5-chloroquinolin-8-yl)amino]methyl]-N-cyclobutyl-1,3-oxazole-4-carboxamide
CID 176989225
6-[(5-chloroquinolin-8-yl)amino]hexanoic acid
CID 116784056
2-(5-chloroquinolin-8-yl)oxy-N-piperidin-4-ylacetamide
CID 119386547
5-chloro-N-cyclohexylquinoline-8-carboxamide
CID 37248042
5-chloro-N-(2-phenylprop-2-enyl)quinolin-8-amine
CID 116783955
3-[(5-chloroquinolin-8-yl)amino]-2-hydroxy-2-methylpropanoic acid
CID 116783958
butyl 2-[(5-chloroquinolin-8-yl)amino]acetate
CID 116783881

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide?
The IUPAC name of 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide (CID 116784065) is 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide is O=C(CNc1ccc(Cl)c2cccnc12)NC1CC1.
What is the InChIKey of 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide?
The InChIKey is ORYCSZJZDHLJPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O/c15-11-5-6-12(14-10(11)2-1-7-16-14)17-8-13(19)18-9-3-4-9/h1-2,5-7,9,17H,3-4,8H2,(H,18,19).
What are the key properties of 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide?
2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide has a molecular weight of 275.74 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloroquinolin-8-yl)amino]-N-cyclopropylacetamide is sourced from PubChem (CID 116784065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).