(6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one

C19H22N4O2 — CID 97464191

IUPAC(6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one
SMILESO=c1ccc2c(n1CCn1cccn1)CC[C@@H](NCc1ccoc1)C2
InChIInChI=1S/C19H22N4O2/c24-19-5-2-16-12-17(20-13-15-6-11-25-14-15)3-4-18(16)23(19)10-9-22-8-1-7-21-22/h1-2,5-8,11,14,17,20H,3-4,9-10,12-13H2/t17-/m1/s1
InChIKeyDIEVRCCRDNPLLJ-QGZVFWFLSA-N
MW338.41 g/mol
LogP1.99
Rot. Bonds6

About (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one

(6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one (PubChem CID 97464191) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one.

Molecular Properties

Compound Name(6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one
PubChem CID97464191
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name(6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one
SMILESO=c1ccc2c(n1CCn1cccn1)CC[C@@H](NCc1ccoc1)C2
InChIInChI=1S/C19H22N4O2/c24-19-5-2-16-12-17(20-13-15-6-11-25-14-15)3-4-18(16)23(19)10-9-22-8-1-7-21-22/h1-2,5-8,11,14,17,20H,3-4,9-10,12-13H2/t17-/m1/s1
InChIKeyDIEVRCCRDNPLLJ-QGZVFWFLSA-N
XLogP1.99
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(6S)-6-(furan-2-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one
CID 97390003
2-[6-(furan-3-ylmethylamino)-2-oxo-5,6,7,8-tetrahydroquinolin-1-yl]-N,N-dimethylacetamide
CID 118742487
1-(2-methoxyethyl)-6-[(4-methoxyphenyl)methylamino]-5,6,7,8-tetrahydroquinolin-2-one
CID 131642052
(6S)-1-[2-(dimethylamino)ethyl]-6-[(5-methylfuran-2-yl)methylamino]-5,6,7,8-tetrahydroquinolin-2-one
CID 97464038
N-(furan-3-ylmethyl)-2,3-dihydro-1H-inden-2-amine
CID 115711462
1-(2-methoxyethyl)-6-[(5-methylthiophen-2-yl)methylamino]-5,6,7,8-tetrahydroquinolin-2-one
CID 131657036
1-(cyclopropylmethyl)-6-[(1-methylpyrazol-4-yl)methylamino]-5,6,7,8-tetrahydroquinolin-2-one;2,2,2-trifluoroacetic acid
CID 155862722
(6R)-1-(cyclopropylmethyl)-6-[(4,5-dimethylfuran-2-yl)methylamino]-5,6,7,8-tetrahydroquinolin-2-one
CID 97464143
1-[2-(dimethylamino)ethyl]-6-(pyrimidin-2-ylamino)-5,6,7,8-tetrahydroquinolin-2-one;dihydrochloride
CID 172894489
(2S)-N-(furan-3-ylmethyl)-2-(2-pyrazol-1-ylethyl)piperidine-1-carboxamide
CID 126439146
N-(furan-3-ylmethyl)thian-4-amine
CID 115585258
(6R)-6-[[(3R)-oxolan-3-yl]amino]-1-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydroquinolin-2-one
CID 97466759

Frequently Asked Questions

What is the IUPAC name of (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one?
The IUPAC name of (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one (CID 97464191) is (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one.
What is the SMILES notation for (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one?
The canonical SMILES for (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one is O=c1ccc2c(n1CCn1cccn1)CC[C@@H](NCc1ccoc1)C2.
What is the InChIKey of (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one?
The InChIKey is DIEVRCCRDNPLLJ-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H22N4O2/c24-19-5-2-16-12-17(20-13-15-6-11-25-14-15)3-4-18(16)23(19)10-9-22-8-1-7-21-22/h1-2,5-8,11,14,17,20H,3-4,9-10,12-13H2/t17-/m1/s1.
What are the key properties of (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one?
(6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one has a molecular weight of 338.41 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-(furan-3-ylmethylamino)-1-(2-pyrazol-1-ylethyl)-5,6,7,8-tetrahydroquinolin-2-one is sourced from PubChem (CID 97464191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).