2-(propylamino)-4-quinolin-5-yloxybutanamide

C16H21N3O2 — CID 103045604

IUPAC2-(propylamino)-4-quinolin-5-yloxybutanamide
SMILESCCCNC(CCOc1cccc2ncccc12)C(N)=O
InChIInChI=1S/C16H21N3O2/c1-2-9-18-14(16(17)20)8-11-21-15-7-3-6-13-12(15)5-4-10-19-13/h3-7,10,14,18H,2,8-9,11H2,1H3,(H2,17,20)
InChIKeyZMZGDLTWYVDPKH-UHFFFAOYSA-N
MW287.36 g/mol
LogP1.86
Rot. Bonds8

About 2-(propylamino)-4-quinolin-5-yloxybutanamide

2-(propylamino)-4-quinolin-5-yloxybutanamide (PubChem CID 103045604) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-(propylamino)-4-quinolin-5-yloxybutanamide.

Molecular Properties

Compound Name2-(propylamino)-4-quinolin-5-yloxybutanamide
PubChem CID103045604
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-(propylamino)-4-quinolin-5-yloxybutanamide
SMILESCCCNC(CCOc1cccc2ncccc12)C(N)=O
InChIInChI=1S/C16H21N3O2/c1-2-9-18-14(16(17)20)8-11-21-15-7-3-6-13-12(15)5-4-10-19-13/h3-7,10,14,18H,2,8-9,11H2,1H3,(H2,17,20)
InChIKeyZMZGDLTWYVDPKH-UHFFFAOYSA-N
XLogP1.86
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(hydroxymethyl)phenoxy]-2-(propylamino)butanamide
CID 63652935
N-propyl-1-quinolin-5-yloxypentan-2-amine
CID 103044496
ethyl 4-(2-methoxyphenoxy)-2-(propylamino)butanoate
CID 63041590
4-(2-methyl-3-nitrophenoxy)-2-(propylamino)butanamide
CID 63041100
N-(2-quinolin-5-yloxyethyl)pentan-3-amine
CID 103045833
3-methyl-N-propyl-1-quinolin-5-yloxybutan-2-amine
CID 103044506
4-(4-ethoxyphenoxy)-2-(propylamino)butanamide
CID 63039148
N-propyl-3-quinolin-5-yloxybutan-2-amine
CID 103044558
3-methyl-N-(2-quinolin-5-yloxyethyl)butan-1-amine
CID 103045848
5-(5-chloro-3-methylpentoxy)quinoline
CID 103044594
2-amino-4-quinolin-5-yloxybutanenitrile
CID 103045532
ethyl 4-(2,5-dimethylphenoxy)-2-(propylamino)butanoate
CID 63040489

Frequently Asked Questions

What is the IUPAC name of 2-(propylamino)-4-quinolin-5-yloxybutanamide?
The IUPAC name of 2-(propylamino)-4-quinolin-5-yloxybutanamide (CID 103045604) is 2-(propylamino)-4-quinolin-5-yloxybutanamide.
What is the SMILES notation for 2-(propylamino)-4-quinolin-5-yloxybutanamide?
The canonical SMILES for 2-(propylamino)-4-quinolin-5-yloxybutanamide is CCCNC(CCOc1cccc2ncccc12)C(N)=O.
What is the InChIKey of 2-(propylamino)-4-quinolin-5-yloxybutanamide?
The InChIKey is ZMZGDLTWYVDPKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-2-9-18-14(16(17)20)8-11-21-15-7-3-6-13-12(15)5-4-10-19-13/h3-7,10,14,18H,2,8-9,11H2,1H3,(H2,17,20).
What are the key properties of 2-(propylamino)-4-quinolin-5-yloxybutanamide?
2-(propylamino)-4-quinolin-5-yloxybutanamide has a molecular weight of 287.36 g/mol, XLogP of 1.86, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propylamino)-4-quinolin-5-yloxybutanamide is sourced from PubChem (CID 103045604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).