2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide

C14H19N3O — CID 62264641

IUPAC2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide
SMILESNc1ccc2c(c1)N(CC(=O)NC1CC1)CCC2
InChIInChI=1S/C14H19N3O/c15-11-4-3-10-2-1-7-17(13(10)8-11)9-14(18)16-12-5-6-12/h3-4,8,12H,1-2,5-7,9,15H2,(H,16,18)
InChIKeyTUSKVEQQWZDUGS-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.30
Rot. Bonds3

About 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide

2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide (PubChem CID 62264641) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide
PubChem CID62264641
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide
SMILESNc1ccc2c(c1)N(CC(=O)NC1CC1)CCC2
InChIInChI=1S/C14H19N3O/c15-11-4-3-10-2-1-7-17(13(10)8-11)9-14(18)16-12-5-6-12/h3-4,8,12H,1-2,5-7,9,15H2,(H,16,18)
InChIKeyTUSKVEQQWZDUGS-UHFFFAOYSA-N
XLogP1.30
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide?
The IUPAC name of 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide (CID 62264641) is 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide.
What is the SMILES notation for 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide?
The canonical SMILES for 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide is Nc1ccc2c(c1)N(CC(=O)NC1CC1)CCC2.
What is the InChIKey of 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide?
The InChIKey is TUSKVEQQWZDUGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c15-11-4-3-10-2-1-7-17(13(10)8-11)9-14(18)16-12-5-6-12/h3-4,8,12H,1-2,5-7,9,15H2,(H,16,18).
What are the key properties of 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide?
2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide has a molecular weight of 245.33 g/mol, XLogP of 1.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropylacetamide is sourced from PubChem (CID 62264641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).