1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine

C12H24N2O — CID 106741043

IUPAC1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine
SMILESCC1CC(CNCC2CCOC2)CCN1
InChIInChI=1S/C12H24N2O/c1-10-6-11(2-4-14-10)7-13-8-12-3-5-15-9-12/h10-14H,2-9H2,1H3
InChIKeyGGSMFSJDZLOQNZ-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.00
Rot. Bonds4

About 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine

1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine (PubChem CID 106741043) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine
PubChem CID106741043
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine
SMILESCC1CC(CNCC2CCOC2)CCN1
InChIInChI=1S/C12H24N2O/c1-10-6-11(2-4-14-10)7-13-8-12-3-5-15-9-12/h10-14H,2-9H2,1H3
InChIKeyGGSMFSJDZLOQNZ-UHFFFAOYSA-N
XLogP1.00
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-N-[(2-methylpiperidin-4-yl)methyl]methanamine
CID 106740929
N-[(4-ethylpiperidin-2-yl)methyl]-1-(oxolan-3-yl)methanamine
CID 114431077
N-(oxolan-3-ylmethyl)-1-piperidin-4-ylmethanamine
CID 62825418
N-(oxolan-3-ylmethyl)-1-pyrrolidin-3-ylmethanamine
CID 63006355
N-[(5-methyloxolan-2-yl)methyl]-1-(oxolan-3-yl)methanamine
CID 82835850
2-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide
CID 79388592
N-(oxolan-3-ylmethyl)propan-1-amine
CID 22355248
2,2,3,3-tetrafluoro-N-[(2-methylpiperidin-4-yl)methyl]propan-1-amine
CID 106293819
N-[(3-methylcyclopentyl)methyl]-1-(oxan-4-yl)methanamine
CID 107412308
N-methyl-1-[(3R)-oxolan-3-yl]methanamine
CID 30427580
1-[(3S)-oxan-3-yl]-N-[[(3S)-oxan-3-yl]methyl]methanamine
CID 129371205
2-chloro-N-(oxolan-3-ylmethyl)propan-1-amine
CID 65024238

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine?
The IUPAC name of 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine (CID 106741043) is 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine.
What is the SMILES notation for 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine?
The canonical SMILES for 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine is CC1CC(CNCC2CCOC2)CCN1.
What is the InChIKey of 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine?
The InChIKey is GGSMFSJDZLOQNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10-6-11(2-4-14-10)7-13-8-12-3-5-15-9-12/h10-14H,2-9H2,1H3.
What are the key properties of 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine?
1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine has a molecular weight of 212.34 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpiperidin-4-yl)-N-(oxolan-3-ylmethyl)methanamine is sourced from PubChem (CID 106741043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).