2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride

C15H29ClN2O2 — CID 120904715

IUPAC2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride
SMILESCC1(CN2CCOC(COCC3CC3)C2)CCNC1.Cl
InChIInChI=1S/C15H28N2O2.ClH/c1-15(4-5-16-11-15)12-17-6-7-19-14(8-17)10-18-9-13-2-3-13;/h13-14,16H,2-12H2,1H3;1H
InChIKeyICPIRJSMDJHSJM-UHFFFAOYSA-N
MW304.86 g/mol
LogP1.54
Rot. Bonds6

About 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride

2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride (PubChem CID 120904715) has the molecular formula C15H29ClN2O2 and a molecular weight of 304.86 g/mol. Its IUPAC name is 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride
PubChem CID120904715
Molecular FormulaC15H29ClN2O2
Molecular Weight304.86 g/mol
Exact Mass304.19
IUPAC Name2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride
SMILESCC1(CN2CCOC(COCC3CC3)C2)CCNC1.Cl
InChIInChI=1S/C15H28N2O2.ClH/c1-15(4-5-16-11-15)12-17-6-7-19-14(8-17)10-18-9-13-2-3-13;/h13-14,16H,2-12H2,1H3;1H
InChIKeyICPIRJSMDJHSJM-UHFFFAOYSA-N
XLogP1.54
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.86
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3-methylpyrrolidin-3-yl)methyl]-2-(phenoxymethyl)morpholine;hydrochloride
CID 120903409
3-(ethoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine
CID 120901494
4-[(3-methylpyrrolidin-3-yl)methyl]-2-(pyrazol-1-ylmethyl)morpholine;hydrochloride
CID 120900223
3-(ethoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]piperidine
CID 120900572
3-(methoxymethyl)-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidine
CID 64596729
4-[(3-methylpyrrolidin-3-yl)methyl]-2-(2-phenylethyl)morpholine
CID 120902311
2-(cyclopropylmethoxymethyl)-4-(piperidin-3-ylmethyl)morpholine;hydrochloride
CID 120852677
4-[[(3R)-1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methyl]morpholine;hydrochloride
CID 120905741
[1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidin-3-yl]methanamine;hydrochloride
CID 131086147
1-[(3-methylpyrrolidin-3-yl)methyl]-3-methylsulfanylpyrrolidine
CID 130979190
[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-3-yl]methanol;hydrochloride
CID 120897177
2-(3-chlorophenyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride
CID 120903950

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride?
The IUPAC name of 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride (CID 120904715) is 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride is CC1(CN2CCOC(COCC3CC3)C2)CCNC1.Cl.
What is the InChIKey of 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride?
The InChIKey is ICPIRJSMDJHSJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2.ClH/c1-15(4-5-16-11-15)12-17-6-7-19-14(8-17)10-18-9-13-2-3-13;/h13-14,16H,2-12H2,1H3;1H.
What are the key properties of 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride?
2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride has a molecular weight of 304.86 g/mol, XLogP of 1.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxymethyl)-4-[(3-methylpyrrolidin-3-yl)methyl]morpholine;hydrochloride is sourced from PubChem (CID 120904715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).