N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride

C12H25ClN2O — CID 119932323

IUPACN-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride
SMILESCN(CC1CCCNC1)CC1CCOC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-14(9-12-4-6-15-10-12)8-11-3-2-5-13-7-11;/h11-13H,2-10H2,1H3;1H
InChIKeyRRKXJHBBNHJNMG-UHFFFAOYSA-N
MW248.80 g/mol
LogP1.38
Rot. Bonds4

About N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride

N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride (PubChem CID 119932323) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride
PubChem CID119932323
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC NameN-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride
SMILESCN(CC1CCCNC1)CC1CCOC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-14(9-12-4-6-15-10-12)8-11-3-2-5-13-7-11;/h11-13H,2-10H2,1H3;1H
InChIKeyRRKXJHBBNHJNMG-UHFFFAOYSA-N
XLogP1.38
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.80
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(oxan-4-yl)-N-(piperidin-3-ylmethyl)ethanamine
CID 115209752
1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)methanamine;hydrochloride
CID 119930005
3-(oxolan-3-ylmethyl)piperidine
CID 63563820
N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine
CID 43611345
N-methyl-N-(piperidin-3-ylmethyl)oxolane-3-carboxamide
CID 106627645
1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
CID 62860068
3-[2-(oxan-4-yl)ethyl]piperidine;hydrochloride
CID 126845728
N-(oxolan-3-ylmethyl)-N-propylpiperidin-3-amine
CID 63638803
2-[methyl(piperidin-3-ylmethyl)amino]-1-morpholin-4-ylethanone;hydrochloride
CID 119930321
N-methyl-N-(oxan-3-ylmethyl)piperidine-3-carboxamide
CID 55227214
2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 84674393
(3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine
CID 86323316

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride?
The IUPAC name of N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride (CID 119932323) is N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride.
What is the SMILES notation for N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride?
The canonical SMILES for N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride is CN(CC1CCCNC1)CC1CCOC1.Cl.
What is the InChIKey of N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride?
The InChIKey is RRKXJHBBNHJNMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-14(9-12-4-6-15-10-12)8-11-3-2-5-13-7-11;/h11-13H,2-10H2,1H3;1H.
What are the key properties of N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride?
N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride is sourced from PubChem (CID 119932323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).