2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol

C19H31N3O — CID 82263568

IUPAC2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
SMILESCCCN1CCCc2ccc(C(O)C(C)N3CCNCC3)cc21
InChIInChI=1S/C19H31N3O/c1-3-10-22-11-4-5-16-6-7-17(14-18(16)22)19(23)15(2)21-12-8-20-9-13-21/h6-7,14-15,19-20,23H,3-5,8-13H2,1-2H3
InChIKeyDQQLCIKHNFDQGO-UHFFFAOYSA-N
MW317.48 g/mol
LogP2.18
Rot. Bonds5

About 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol

2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol (PubChem CID 82263568) has the molecular formula C19H31N3O and a molecular weight of 317.48 g/mol. Its IUPAC name is 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol.

Molecular Properties

Compound Name2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
PubChem CID82263568
Molecular FormulaC19H31N3O
Molecular Weight317.48 g/mol
Exact Mass317.25
IUPAC Name2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
SMILESCCCN1CCCc2ccc(C(O)C(C)N3CCNCC3)cc21
InChIInChI=1S/C19H31N3O/c1-3-10-22-11-4-5-16-6-7-17(14-18(16)22)19(23)15(2)21-12-8-20-9-13-21/h6-7,14-15,19-20,23H,3-5,8-13H2,1-2H3
InChIKeyDQQLCIKHNFDQGO-UHFFFAOYSA-N
XLogP2.18
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.48
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol with MolForge

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Related Compounds

2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
CID 82263571
7-(2-piperazin-1-ylethyl)-1-propyl-3,4-dihydro-2H-quinoline
CID 82263573
4-(1-hydroxy-2-piperazin-1-ylpropyl)phenol
CID 82263328
1-phenyl-2-piperazin-1-ylpropan-1-ol
CID 82264476
7-[(2R)-butan-2-yl]-1-pentyl-3,4-dihydro-2H-quinoline;4-(4-ethylphenyl)piperidine
CID 143066340
2-chloro-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)ethanone
CID 82263545
1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-3-piperazin-1-ylpropan-1-ol
CID 82074067
5-oxo-5-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)pentanoic acid
CID 82263541
2-[6-[1-(propylamino)ethyl]-3,4-dihydro-2H-quinolin-1-yl]ethanol
CID 102662122
ethyl 2-amino-3-hydroxy-3-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)propanoate
CID 115481721
N-methyl-1-piperazin-1-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 116954775
N-ethyl-1-(1-pentyl-3,4-dihydro-2H-quinolin-6-yl)ethanamine
CID 102662084

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol?
The IUPAC name of 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol (CID 82263568) is 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol.
What is the SMILES notation for 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol?
The canonical SMILES for 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol is CCCN1CCCc2ccc(C(O)C(C)N3CCNCC3)cc21.
What is the InChIKey of 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol?
The InChIKey is DQQLCIKHNFDQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O/c1-3-10-22-11-4-5-16-6-7-17(14-18(16)22)19(23)15(2)21-12-8-20-9-13-21/h6-7,14-15,19-20,23H,3-5,8-13H2,1-2H3.
What are the key properties of 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol?
2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol has a molecular weight of 317.48 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol is sourced from PubChem (CID 82263568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).