1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea

C15H21N3O2 — CID 118739034

IUPAC1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea
SMILESO=C(NC1CCCC1)NC1CCc2[nH]c(=O)ccc2C1
InChIInChI=1S/C15H21N3O2/c19-14-8-5-10-9-12(6-7-13(10)18-14)17-15(20)16-11-3-1-2-4-11/h5,8,11-12H,1-4,6-7,9H2,(H,18,19)(H2,16,17,20)
InChIKeyZQZKVABHRKXNPN-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.47
Rot. Bonds2

About 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea

1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea (PubChem CID 118739034) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea.

Molecular Properties

Compound Name1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea
PubChem CID118739034
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea
SMILESO=C(NC1CCCC1)NC1CCc2[nH]c(=O)ccc2C1
InChIInChI=1S/C15H21N3O2/c19-14-8-5-10-9-12(6-7-13(10)18-14)17-15(20)16-11-3-1-2-4-11/h5,8,11-12H,1-4,6-7,9H2,(H,18,19)(H2,16,17,20)
InChIKeyZQZKVABHRKXNPN-UHFFFAOYSA-N
XLogP1.47
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea with MolForge

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Related Compounds

5-Amino-1-(3-methyl-but-2-enyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one
CID 10263358
5-amino-5,6,7,8-tetrahydroquinolin-2(1H)-one
CID 5148061
5-(Butylamino)-5,6,7,8-tetrahydro-2(1H)-quinolinone
CID 10656568
5-Amino-1-methyl-1,2,5,6,7,8-hexahydroquinolin-2-one
CID 81105195
6-Amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2(1H)-one
CID 84618285
6-Amino-1-isobutyl-5,6,7,8-tetrahydroquinolin-2(1H)-one
CID 118738743
6-(propan-2-ylamino)-5,6,7,8-tetrahydro-1H-quinolin-2-one
CID 118744521
1-Cyclopentyl-3-[1-[2-(dimethylamino)ethyl]-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]urea
CID 118744569
N-(2-oxo-1-prop-2-enyl-5,6,7,8-tetrahydroquinolin-6-yl)pyrrolidine-1-carboxamide
CID 131663860
N-[1-[2-(dimethylamino)ethyl]-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]pyrrolidine-1-carboxamide
CID 134076214
N-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)pyrrolidine-1-carboxamide
CID 134078461
butyl-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-5-yl)azanide
CID 22890958

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea?
The IUPAC name of 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea (CID 118739034) is 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea.
What is the SMILES notation for 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea?
The canonical SMILES for 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea is O=C(NC1CCCC1)NC1CCc2[nH]c(=O)ccc2C1.
What is the InChIKey of 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea?
The InChIKey is ZQZKVABHRKXNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c19-14-8-5-10-9-12(6-7-13(10)18-14)17-15(20)16-11-3-1-2-4-11/h5,8,11-12H,1-4,6-7,9H2,(H,18,19)(H2,16,17,20).
What are the key properties of 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea?
1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea has a molecular weight of 275.35 g/mol, XLogP of 1.47, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(2-oxo-5,6,7,8-tetrahydro-1H-quinolin-6-yl)urea is sourced from PubChem (CID 118739034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).