2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide

C23H24N2O2 — CID 170511987

IUPAC2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide
SMILESCC(C)Oc1cccc(-c2cc(C3CC3)c3ccc(CC(N)=O)cc3n2)c1
InChIInChI=1S/C23H24N2O2/c1-14(2)27-18-5-3-4-17(12-18)21-13-20(16-7-8-16)19-9-6-15(11-23(24)26)10-22(19)25-21/h3-6,9-10,12-14,16H,7-8,11H2,1-2H3,(H2,24,26)
InChIKeyGOAMFAKYZCNZTL-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.59
Rot. Bonds6

About 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide

2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide (PubChem CID 170511987) has the molecular formula C23H24N2O2 and a molecular weight of 360.46 g/mol. Its IUPAC name is 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide.

Molecular Properties

Compound Name2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide
PubChem CID170511987
Molecular FormulaC23H24N2O2
Molecular Weight360.46 g/mol
Exact Mass360.18
IUPAC Name2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide
SMILESCC(C)Oc1cccc(-c2cc(C3CC3)c3ccc(CC(N)=O)cc3n2)c1
InChIInChI=1S/C23H24N2O2/c1-14(2)27-18-5-3-4-17(12-18)21-13-20(16-7-8-16)19-9-6-15(11-23(24)26)10-22(19)25-21/h3-6,9-10,12-14,16H,7-8,11H2,1-2H3,(H2,24,26)
InChIKeyGOAMFAKYZCNZTL-UHFFFAOYSA-N
XLogP4.59
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide?
The IUPAC name of 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide (CID 170511987) is 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide.
What is the SMILES notation for 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide?
The canonical SMILES for 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide is CC(C)Oc1cccc(-c2cc(C3CC3)c3ccc(CC(N)=O)cc3n2)c1.
What is the InChIKey of 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide?
The InChIKey is GOAMFAKYZCNZTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2/c1-14(2)27-18-5-3-4-17(12-18)21-13-20(16-7-8-16)19-9-6-15(11-23(24)26)10-22(19)25-21/h3-6,9-10,12-14,16H,7-8,11H2,1-2H3,(H2,24,26).
What are the key properties of 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide?
2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide has a molecular weight of 360.46 g/mol, XLogP of 4.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-cyclopropyl-2-(3-propan-2-yloxyphenyl)quinolin-7-yl]acetamide is sourced from PubChem (CID 170511987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).