2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile

C15H17N3O — CID 103045526

IUPAC2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile
SMILESCC(CC(C)(N)C#N)Oc1cccc2ncccc12
InChIInChI=1S/C15H17N3O/c1-11(9-15(2,17)10-16)19-14-7-3-6-13-12(14)5-4-8-18-13/h3-8,11H,9,17H2,1-2H3
InChIKeySBYVVHBPJFLERH-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.63
Rot. Bonds4

About 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile

2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile (PubChem CID 103045526) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile.

Molecular Properties

Compound Name2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile
PubChem CID103045526
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile
SMILESCC(CC(C)(N)C#N)Oc1cccc2ncccc12
InChIInChI=1S/C15H17N3O/c1-11(9-15(2,17)10-16)19-14-7-3-6-13-12(14)5-4-8-18-13/h3-8,11H,9,17H2,1-2H3
InChIKeySBYVVHBPJFLERH-UHFFFAOYSA-N
XLogP2.63
TPSA71.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-4-(2-ethylphenoxy)-2-methylpentanenitrile
CID 64725627
2-amino-4-(2,4-difluorophenoxy)-2-methylpentanenitrile
CID 64727389
3-amino-2-quinolin-5-yloxybutan-1-ol
CID 103044560
2-amino-4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-2-methylpentanenitrile
CID 64725603
2-methyl-2-(methylamino)-5-quinolin-5-yloxypentanenitrile
CID 103045530
2-amino-4-quinolin-5-yloxybutanenitrile
CID 103045532
3-methoxy-N-propan-2-yl-2-quinolin-5-yloxypropan-1-amine
CID 103229133
5-(3,3-dimethylbutoxy)quinoline
CID 59667943
2-amino-2-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pentanenitrile
CID 64725441
N-propyl-3-quinolin-5-yloxybutan-2-amine
CID 103044558
2-quinolin-5-yloxypyridin-3-amine
CID 103043871
O-quinolin-5-ylhydroxylamine;hydrochloride
CID 162421843

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile?
The IUPAC name of 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile (CID 103045526) is 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile.
What is the SMILES notation for 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile?
The canonical SMILES for 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile is CC(CC(C)(N)C#N)Oc1cccc2ncccc12.
What is the InChIKey of 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile?
The InChIKey is SBYVVHBPJFLERH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-11(9-15(2,17)10-16)19-14-7-3-6-13-12(14)5-4-8-18-13/h3-8,11H,9,17H2,1-2H3.
What are the key properties of 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile?
2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile has a molecular weight of 255.32 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-4-quinolin-5-yloxypentanenitrile is sourced from PubChem (CID 103045526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).