2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide

C15H23N3O — CID 81214863

IUPAC2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN(C)c1cccc2c1NCCC2
InChIInChI=1S/C15H23N3O/c1-11(2)17-14(19)10-18(3)13-8-4-6-12-7-5-9-16-15(12)13/h4,6,8,11,16H,5,7,9-10H2,1-3H3,(H,17,19)
InChIKeyUMQAMKJTDURBLL-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.01
Rot. Bonds4

About 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide

2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide (PubChem CID 81214863) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide
PubChem CID81214863
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN(C)c1cccc2c1NCCC2
InChIInChI=1S/C15H23N3O/c1-11(2)17-14(19)10-18(3)13-8-4-6-12-7-5-9-16-15(12)13/h4,6,8,11,16H,5,7,9-10H2,1-3H3,(H,17,19)
InChIKeyUMQAMKJTDURBLL-UHFFFAOYSA-N
XLogP2.01
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]acetamide
CID 103102716
1-propan-2-yl-3-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]urea
CID 81423411
2-(2-amino-N,3-dimethylanilino)-N-propan-2-ylacetamide
CID 114041230
2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]benzoic acid
CID 55037894
N-ethyl-N-(2-methylpropyl)-1,2,3,4-tetrahydroquinolin-8-amine
CID 81215124
N-propan-2-yl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
CID 43117555
N-pentan-2-yl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)acetamide
CID 61026655
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-1,2,3,4-tetrahydroquinolin-8-amine
CID 81214603
N-(1-pyrazol-1-ylpropan-2-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62213653
2-(2-amino-N-methyl-3-methylsulfonylanilino)-N-propan-2-ylacetamide
CID 82002404
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62215091
2-[methyl(1,2,3,4-tetrahydroquinolin-5-yl)amino]-N-propylacetamide
CID 81214576

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide (CID 81214863) is 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide is CC(C)NC(=O)CN(C)c1cccc2c1NCCC2.
What is the InChIKey of 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide?
The InChIKey is UMQAMKJTDURBLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(2)17-14(19)10-18(3)13-8-4-6-12-7-5-9-16-15(12)13/h4,6,8,11,16H,5,7,9-10H2,1-3H3,(H,17,19).
What are the key properties of 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide?
2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide has a molecular weight of 261.37 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(1,2,3,4-tetrahydroquinolin-8-yl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 81214863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).