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

C20H33N3O — CID 82263571

IUPAC2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
SMILESCCCN1CCCc2ccc(C(O)C(C)CN3CCNCC3)cc21
InChIInChI=1S/C20H33N3O/c1-3-10-23-11-4-5-17-6-7-18(14-19(17)23)20(24)16(2)15-22-12-8-21-9-13-22/h6-7,14,16,20-21,24H,3-5,8-13,15H2,1-2H3
InChIKeyCIZAKDPPIAXJQB-UHFFFAOYSA-N
MW331.50 g/mol
LogP2.42
Rot. Bonds6

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

2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol (PubChem CID 82263571) has the molecular formula C20H33N3O and a molecular weight of 331.50 g/mol. Its IUPAC name is 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
PubChem CID82263571
Molecular FormulaC20H33N3O
Molecular Weight331.50 g/mol
Exact Mass331.26
IUPAC Name2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
SMILESCCCN1CCCc2ccc(C(O)C(C)CN3CCNCC3)cc21
InChIInChI=1S/C20H33N3O/c1-3-10-23-11-4-5-17-6-7-18(14-19(17)23)20(24)16(2)15-22-12-8-21-9-13-22/h6-7,14,16,20-21,24H,3-5,8-13,15H2,1-2H3
InChIKeyCIZAKDPPIAXJQB-UHFFFAOYSA-N
XLogP2.42
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.50
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol
CID 82263568
7-(2-piperazin-1-ylethyl)-1-propyl-3,4-dihydro-2H-quinoline
CID 82263573
1-(3-tert-butyl-4-ethoxyphenyl)-2-methyl-3-piperazin-1-ylpropan-1-ol
CID 82263878
2-methyl-1-(4-methylsulfanylphenyl)-3-piperazin-1-ylpropan-1-ol
CID 82264442
2-methyl-1-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)-3-piperazin-1-ylpropan-1-one
CID 82263492
1-(4-piperazin-1-ylbutyl)-3,4-dihydro-2H-quinoline
CID 28808284
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
3-piperazin-1-yl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-ol
CID 82073590
1-(2,3-dihydro-1H-inden-5-yl)-N,N-diethyl-2-piperazin-1-ylethanamine
CID 82201862
1-(1-pentyl-3,4-dihydro-2H-quinolin-6-yl)ethanamine
CID 102661907

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol?
The IUPAC name of 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol (CID 82263571) is 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol?
The canonical SMILES for 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol is CCCN1CCCc2ccc(C(O)C(C)CN3CCNCC3)cc21.
What is the InChIKey of 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol?
The InChIKey is CIZAKDPPIAXJQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N3O/c1-3-10-23-11-4-5-17-6-7-18(14-19(17)23)20(24)16(2)15-22-12-8-21-9-13-22/h6-7,14,16,20-21,24H,3-5,8-13,15H2,1-2H3.
What are the key properties of 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol?
2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol has a molecular weight of 331.50 g/mol, XLogP of 2.42, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-piperazin-1-yl-1-(1-propyl-3,4-dihydro-2H-quinolin-7-yl)propan-1-ol is sourced from PubChem (CID 82263571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).