2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide

C15H21N3O — CID 122080484

IUPAC2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide
SMILESO=C(CNCC1CC1)Nc1ccc2c(c1)CCCN2
InChIInChI=1S/C15H21N3O/c19-15(10-16-9-11-3-4-11)18-13-5-6-14-12(8-13)2-1-7-17-14/h5-6,8,11,16-17H,1-4,7,9-10H2,(H,18,19)
InChIKeyQVCYCBWVBDKURK-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.98
Rot. Bonds5

About 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide

2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide (PubChem CID 122080484) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide
PubChem CID122080484
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide
SMILESO=C(CNCC1CC1)Nc1ccc2c(c1)CCCN2
InChIInChI=1S/C15H21N3O/c19-15(10-16-9-11-3-4-11)18-13-5-6-14-12(8-13)2-1-7-17-14/h5-6,8,11,16-17H,1-4,7,9-10H2,(H,18,19)
InChIKeyQVCYCBWVBDKURK-UHFFFAOYSA-N
XLogP1.98
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclopentyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide
CID 62632415
2-cyclobutyl-N-(2,3-dihydro-1H-indol-5-yl)acetamide;hydrochloride
CID 119473771
1-cyclopropyl-3-(1,2,3,4-tetrahydroquinolin-6-yl)urea
CID 62698159
N-(1,2,3,4-tetrahydroquinolin-6-yl)cycloheptanecarboxamide
CID 62633858
2-cyclohexyl-N-(1,2,3,4-tetrahydroquinolin-7-yl)acetamide
CID 63931236
2-pyrazol-1-yl-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide
CID 63282524
N-(1,2,3,4-tetrahydroquinolin-6-yl)cyclopent-3-ene-1-carboxamide
CID 64767021
2-acetamido-N-(2,3-dihydro-1H-indol-5-yl)acetamide
CID 63253037
2-(cyclopropylmethylamino)-N-(3,4-dimethylphenyl)acetamide;hydrochloride
CID 119670640
N-(1,2,3,4-tetrahydroquinolin-6-yl)thiolane-2-carboxamide;hydrochloride
CID 119547205
2-oxo-N-(1,2,3,4-tetrahydroquinolin-6-yl)-1,3-thiazolidine-4-carboxamide
CID 63283396
N-(1,2,3,4-tetrahydroquinolin-6-yl)oxolane-3-carboxamide
CID 55138702

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide (CID 122080484) is 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide is O=C(CNCC1CC1)Nc1ccc2c(c1)CCCN2.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide?
The InChIKey is QVCYCBWVBDKURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c19-15(10-16-9-11-3-4-11)18-13-5-6-14-12(8-13)2-1-7-17-14/h5-6,8,11,16-17H,1-4,7,9-10H2,(H,18,19).
What are the key properties of 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide?
2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide has a molecular weight of 259.35 g/mol, XLogP of 1.98, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(1,2,3,4-tetrahydroquinolin-6-yl)acetamide is sourced from PubChem (CID 122080484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).