2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide

C16H21N3O — CID 105378874

IUPAC2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide
SMILESCc1ccc2cc(C(NCC(C)C)C(N)=O)ccc2n1
InChIInChI=1S/C16H21N3O/c1-10(2)9-18-15(16(17)20)13-6-7-14-12(8-13)5-4-11(3)19-14/h4-8,10,15,18H,9H2,1-3H3,(H2,17,20)
InChIKeyKWEGLOKSPMLMFK-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.32
Rot. Bonds5

About 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide

2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide (PubChem CID 105378874) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide.

Molecular Properties

Compound Name2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide
PubChem CID105378874
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC Name2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide
SMILESCc1ccc2cc(C(NCC(C)C)C(N)=O)ccc2n1
InChIInChI=1S/C16H21N3O/c1-10(2)9-18-15(16(17)20)13-6-7-14-12(8-13)5-4-11(3)19-14/h4-8,10,15,18H,9H2,1-3H3,(H2,17,20)
InChIKeyKWEGLOKSPMLMFK-UHFFFAOYSA-N
XLogP2.32
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)ethanol
CID 105379246
methyl 2-(ethylamino)-2-(2-methylquinolin-6-yl)acetate
CID 105378902
ethyl 2-(2-methylquinolin-6-yl)-2-(prop-2-enylamino)acetate
CID 105378922
2-(4-chlorophenyl)-2-(2-methylpropylamino)acetamide
CID 60995659
2-(4-bromo-3-fluorophenyl)-2-(2-methylpropylamino)acetamide
CID 81436324
2-(4-ethoxyphenyl)-2-(2-methylpropylamino)acetamide
CID 54891036
4-hydroxy-3-methyl-4-(2-methylquinolin-6-yl)butanoic acid
CID 105379295
2-(3,5-dimethoxyphenyl)-2-(2-methylpropylamino)acetamide
CID 54891131
[2-methyl-1-(2-methylquinolin-6-yl)propyl]hydrazine
CID 105199572
N,4-dimethyl-1-(2-methylquinolin-6-yl)pentan-1-amine
CID 81231235
2-[hydroxy-(2-methylquinolin-6-yl)methyl]-3-methylbutanoic acid
CID 105379523
2-[4-(2-amino-2-oxoethoxy)phenyl]-2-(2-methylpropylamino)acetamide
CID 60995072

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide?
The IUPAC name of 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide (CID 105378874) is 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide.
What is the SMILES notation for 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide?
The canonical SMILES for 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide is Cc1ccc2cc(C(NCC(C)C)C(N)=O)ccc2n1.
What is the InChIKey of 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide?
The InChIKey is KWEGLOKSPMLMFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c1-10(2)9-18-15(16(17)20)13-6-7-14-12(8-13)5-4-11(3)19-14/h4-8,10,15,18H,9H2,1-3H3,(H2,17,20).
What are the key properties of 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide?
2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide has a molecular weight of 271.36 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropylamino)-2-(2-methylquinolin-6-yl)acetamide is sourced from PubChem (CID 105378874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).