[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride

C12H25ClN2O — CID 120897177

IUPAC[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride
SMILESCC1(CN2CCCC(CO)C2)CCNC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-12(4-5-13-9-12)10-14-6-2-3-11(7-14)8-15;/h11,13,15H,2-10H2,1H3;1H
InChIKeyRKWFVJGFPFNRDL-UHFFFAOYSA-N
MW248.80 g/mol
LogP1.11
Rot. Bonds3

About [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride

[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride (PubChem CID 120897177) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride.

Molecular Properties

Compound Name[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride
PubChem CID120897177
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC Name[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride
SMILESCC1(CN2CCCC(CO)C2)CCNC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-12(4-5-13-9-12)10-14-6-2-3-11(7-14)8-15;/h11,13,15H,2-10H2,1H3;1H
InChIKeyRKWFVJGFPFNRDL-UHFFFAOYSA-N
XLogP1.11
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.80
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(3R)-1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methyl]morpholine;hydrochloride
CID 120905741
3-(ethoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]piperidine
CID 120900572
3-[(4-methylpiperidin-1-yl)methyl]-1-[(3-methylpyrrolidin-3-yl)methyl]piperidine
CID 120899331
N-[[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methyl]acetamide
CID 120897218
3-ethyl-1-[(4-methylpiperidin-4-yl)methyl]piperidine
CID 63122767
[1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidin-3-yl]methanamine;hydrochloride
CID 131086147
1-[(3-methylpyrrolidin-3-yl)methyl]piperidine-3-carboxamide
CID 120897194
1-[(3-methylpyrrolidin-3-yl)methyl]-3-(triazol-1-ylmethyl)piperidine;hydrochloride
CID 120901831
[1-[(4-methyloxan-4-yl)methyl]piperidin-3-yl]methanol
CID 104585504
N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]acetamide;hydrochloride
CID 120898475
3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine
CID 64596729
1-[(3-methylpyrrolidin-3-yl)methyl]-3-pyrrolidin-1-ylazepane
CID 120899609

Frequently Asked Questions

What is the IUPAC name of [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride?
The IUPAC name of [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride (CID 120897177) is [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride.
What is the SMILES notation for [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride?
The canonical SMILES for [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride is CC1(CN2CCCC(CO)C2)CCNC1.Cl.
What is the InChIKey of [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride?
The InChIKey is RKWFVJGFPFNRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-12(4-5-13-9-12)10-14-6-2-3-11(7-14)8-15;/h11,13,15H,2-10H2,1H3;1H.
What are the key properties of [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride?
[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride is sourced from PubChem (CID 120897177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).