[4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol

C17H23N3O — CID 79311164

IUPAC[4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol
SMILESCN(CC1CCCN1C)c1cc(CO)nc2ccccc12
InChIInChI=1S/C17H23N3O/c1-19-9-5-6-14(19)11-20(2)17-10-13(12-21)18-16-8-4-3-7-15(16)17/h3-4,7-8,10,14,21H,5-6,9,11-12H2,1-2H3
InChIKeyNJGGJCUHTNGOBT-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.26
Rot. Bonds4

About [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol

[4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol (PubChem CID 79311164) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol.

Molecular Properties

Compound Name[4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol
PubChem CID79311164
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name[4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol
SMILESCN(CC1CCCN1C)c1cc(CO)nc2ccccc12
InChIInChI=1S/C17H23N3O/c1-19-9-5-6-14(19)11-20(2)17-10-13(12-21)18-16-8-4-3-7-15(16)17/h3-4,7-8,10,14,21H,5-6,9,11-12H2,1-2H3
InChIKeyNJGGJCUHTNGOBT-UHFFFAOYSA-N
XLogP2.26
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol 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

[4-[cyclohexylmethyl(methyl)amino]quinolin-2-yl]methanol
CID 63375839
[4-[2-methoxyethyl(methyl)amino]quinolin-2-yl]methanol
CID 63376401
1-[[[2-(hydroxymethyl)quinolin-4-yl]-methylamino]methyl]cyclopentan-1-ol
CID 114952352
[4-bromo-2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]phenyl]methanol
CID 79319074
[4-[3-methoxypropyl(methyl)amino]quinolin-2-yl]methanol
CID 63375970
[4-[furan-3-ylmethyl(methyl)amino]quinolin-2-yl]methanol
CID 63376321
[1-[(1-methylpiperidin-2-yl)methoxy]isoquinolin-3-yl]methanol
CID 65467106
N-methyl-N-[[(2S)-1-methylpiperidin-2-yl]methyl]aniline
CID 57253639
1-[4-[[(2-ethylquinolin-4-yl)-methylamino]methyl]piperidin-1-yl]propan-2-ol
CID 133401409
[4-[butyl(cyclopropyl)amino]quinolin-2-yl]methanol
CID 63375838
4-amino-2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]benzoic acid
CID 79312601
[4,6-dimethyl-2-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]-3-pyridinyl]methanol
CID 79319243

Frequently Asked Questions

What is the IUPAC name of [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol?
The IUPAC name of [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol (CID 79311164) is [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol.
What is the SMILES notation for [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol?
The canonical SMILES for [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol is CN(CC1CCCN1C)c1cc(CO)nc2ccccc12.
What is the InChIKey of [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol?
The InChIKey is NJGGJCUHTNGOBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-19-9-5-6-14(19)11-20(2)17-10-13(12-21)18-16-8-4-3-7-15(16)17/h3-4,7-8,10,14,21H,5-6,9,11-12H2,1-2H3.
What are the key properties of [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol?
[4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol has a molecular weight of 285.39 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]quinolin-2-yl]methanol is sourced from PubChem (CID 79311164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).