(2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide

C21H28N2O3 — CID 100778843

IUPAC(2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide
SMILESCCCO[C@@](C)(C(=O)Nc1ccc(OC(C)C)c2ncccc12)C1CC1
InChIInChI=1S/C21H28N2O3/c1-5-13-25-21(4,15-8-9-15)20(24)23-17-10-11-18(26-14(2)3)19-16(17)7-6-12-22-19/h6-7,10-12,14-15H,5,8-9,13H2,1-4H3,(H,23,24)/t21-/m1/s1
InChIKeyDXPFHUHSLGSHKG-OAQYLSRUSA-N
MW356.47 g/mol
LogP4.56
Rot. Bonds8

About (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide

(2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide (PubChem CID 100778843) has the molecular formula C21H28N2O3 and a molecular weight of 356.47 g/mol. Its IUPAC name is (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide.

Molecular Properties

Compound Name(2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide
PubChem CID100778843
Molecular FormulaC21H28N2O3
Molecular Weight356.47 g/mol
Exact Mass356.21
IUPAC Name(2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide
SMILESCCCO[C@@](C)(C(=O)Nc1ccc(OC(C)C)c2ncccc12)C1CC1
InChIInChI=1S/C21H28N2O3/c1-5-13-25-21(4,15-8-9-15)20(24)23-17-10-11-18(26-14(2)3)19-16(17)7-6-12-22-19/h6-7,10-12,14-15H,5,8-9,13H2,1-4H3,(H,23,24)/t21-/m1/s1
InChIKeyDXPFHUHSLGSHKG-OAQYLSRUSA-N
XLogP4.56
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-N-[8-(2-methylpropoxy)quinolin-5-yl]-2-propoxypropanamide
CID 133206007
2-methyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide
CID 100777551
(2S)-2-cyclopropyl-2-ethoxy-N-(8-methoxyquinolin-5-yl)propanamide
CID 100777479
(2R)-2-methoxy-2-methyl-N-(8-propan-2-yloxyquinolin-5-yl)hexanamide
CID 100774849
2-methoxy-2,4-dimethyl-N-(8-propan-2-yloxyquinolin-5-yl)pentanamide
CID 133205573
2,2-dimethyl-N-(8-propoxyquinolin-5-yl)propanamide
CID 100773580
(2R)-2,4-dimethyl-2-propoxy-N-(8-propoxyquinolin-5-yl)pentanamide
CID 100777802
N-(8-ethoxyquinolin-5-yl)-2,4-dimethyl-2-propoxypentanamide
CID 133205883
(2S)-N-(8-ethoxyquinolin-5-yl)-2,4-dimethyl-2-propoxypentanamide
CID 100777796
2-ethoxy-2-methyl-N-(8-propoxyquinolin-5-yl)propanamide
CID 100775972
(2R)-N-(4-butoxynaphthalen-1-yl)-2-cyclopropyl-2-ethoxypropanamide
CID 100763689
N-(8-butoxyquinolin-5-yl)-2,2-dimethylpropanamide
CID 100773589

Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide?
The IUPAC name of (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide (CID 100778843) is (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide.
What is the SMILES notation for (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide?
The canonical SMILES for (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide is CCCO[C@@](C)(C(=O)Nc1ccc(OC(C)C)c2ncccc12)C1CC1.
What is the InChIKey of (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide?
The InChIKey is DXPFHUHSLGSHKG-OAQYLSRUSA-N. The full InChI is InChI=1S/C21H28N2O3/c1-5-13-25-21(4,15-8-9-15)20(24)23-17-10-11-18(26-14(2)3)19-16(17)7-6-12-22-19/h6-7,10-12,14-15H,5,8-9,13H2,1-4H3,(H,23,24)/t21-/m1/s1.
What are the key properties of (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide?
(2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide has a molecular weight of 356.47 g/mol, XLogP of 4.56, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyclopropyl-N-(8-propan-2-yloxyquinolin-5-yl)-2-propoxypropanamide is sourced from PubChem (CID 100778843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).