4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol

C21H23N3O — CID 67275109

IUPAC4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol
SMILESCN(c1ccccc1)C1CCN(c2c(O)cnc3ccccc23)CC1
InChIInChI=1S/C21H23N3O/c1-23(16-7-3-2-4-8-16)17-11-13-24(14-12-17)21-18-9-5-6-10-19(18)22-15-20(21)25/h2-10,15,17,25H,11-14H2,1H3
InChIKeyDMEPBECFFKIHNU-UHFFFAOYSA-N
MW333.44 g/mol
LogP4.05
Rot. Bonds3

About 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol

4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol (PubChem CID 67275109) has the molecular formula C21H23N3O and a molecular weight of 333.44 g/mol. Its IUPAC name is 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol.

Molecular Properties

Compound Name4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol
PubChem CID67275109
Molecular FormulaC21H23N3O
Molecular Weight333.44 g/mol
Exact Mass333.18
IUPAC Name4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol
SMILESCN(c1ccccc1)C1CCN(c2c(O)cnc3ccccc23)CC1
InChIInChI=1S/C21H23N3O/c1-23(16-7-3-2-4-8-16)17-11-13-24(14-12-17)21-18-9-5-6-10-19(18)22-15-20(21)25/h2-10,15,17,25H,11-14H2,1H3
InChIKeyDMEPBECFFKIHNU-UHFFFAOYSA-N
XLogP4.05
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol?
The IUPAC name of 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol (CID 67275109) is 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol.
What is the SMILES notation for 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol?
The canonical SMILES for 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol is CN(c1ccccc1)C1CCN(c2c(O)cnc3ccccc23)CC1.
What is the InChIKey of 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol?
The InChIKey is DMEPBECFFKIHNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O/c1-23(16-7-3-2-4-8-16)17-11-13-24(14-12-17)21-18-9-5-6-10-19(18)22-15-20(21)25/h2-10,15,17,25H,11-14H2,1H3.
What are the key properties of 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol?
4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol has a molecular weight of 333.44 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(N-methylanilino)piperidin-1-yl]quinolin-3-ol is sourced from PubChem (CID 67275109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).