[4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol

C18H28N2O — CID 110009557

IUPAC[4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol
SMILESCC1CCCN1C1CCN(Cc2ccc(CO)cc2)CC1
InChIInChI=1S/C18H28N2O/c1-15-3-2-10-20(15)18-8-11-19(12-9-18)13-16-4-6-17(14-21)7-5-16/h4-7,15,18,21H,2-3,8-14H2,1H3
InChIKeyOIIKMNRNWZBZTO-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.63
Rot. Bonds4

About [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol

[4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol (PubChem CID 110009557) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol.

Molecular Properties

Compound Name[4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol
PubChem CID110009557
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name[4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol
SMILESCC1CCCN1C1CCN(Cc2ccc(CO)cc2)CC1
InChIInChI=1S/C18H28N2O/c1-15-3-2-10-20(15)18-8-11-19(12-9-18)13-16-4-6-17(14-21)7-5-16/h4-7,15,18,21H,2-3,8-14H2,1H3
InChIKeyOIIKMNRNWZBZTO-UHFFFAOYSA-N
XLogP2.63
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol with MolForge

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Related Compounds

1-benzyl-4-[(2R)-2-methylpiperidin-1-yl]piperidine
CID 30983085
[4-[(4-ethylazepan-1-yl)methyl]phenyl]methanol
CID 112631282
[4-[(4-methoxypiperidin-1-yl)methyl]phenyl]methanol
CID 112631146
[4-[[4-[[4-(hydroxymethyl)phenyl]methyl]-3-methylpiperazin-1-yl]methyl]phenyl]methanol
CID 75517917
2-methyl-1-[4-[[(3S)-3-[(2S)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]methyl]phenyl]benzimidazole
CID 24897441
4-methyl-1-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]piperidine
CID 53443850
N-[(1-benzylpiperidin-4-yl)methyl]-3-[(2R)-2-methylpiperidin-1-yl]azetidine-1-carboxamide
CID 126423909
[4-[(2,3-dimethylpiperidin-1-yl)methyl]phenyl]methanol
CID 112631290
5-fluoro-1-[[4-[[3-[(2R)-2-methylpyrrolidin-1-yl]pyrrolidin-1-yl]methyl]phenyl]methyl]benzimidazole
CID 25031984
[4-[[4-[3-(dimethylamino)propyl]piperidin-1-yl]methyl]phenyl]methanol
CID 110009724
1-[(4-ethylphenyl)methyl]-4-(3-methylpiperidin-1-yl)piperidine
CID 2910705
[4-[(3-propylpyrrolidin-1-yl)methyl]phenyl]methanol
CID 113356734

Frequently Asked Questions

What is the IUPAC name of [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol?
The IUPAC name of [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol (CID 110009557) is [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol.
What is the SMILES notation for [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol?
The canonical SMILES for [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol is CC1CCCN1C1CCN(Cc2ccc(CO)cc2)CC1.
What is the InChIKey of [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol?
The InChIKey is OIIKMNRNWZBZTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-15-3-2-10-20(15)18-8-11-19(12-9-18)13-16-4-6-17(14-21)7-5-16/h4-7,15,18,21H,2-3,8-14H2,1H3.
What are the key properties of [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol?
[4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol has a molecular weight of 288.44 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[4-(2-methylpyrrolidin-1-yl)piperidin-1-yl]methyl]phenyl]methanol is sourced from PubChem (CID 110009557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).