(3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine

C12H24N2O — CID 86323316

IUPAC(3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine
SMILESCN(CC1CCOCC1)[C@@H]1CCCNC1
InChIInChI=1S/C12H24N2O/c1-14(12-3-2-6-13-9-12)10-11-4-7-15-8-5-11/h11-13H,2-10H2,1H3/t12-/m1/s1
InChIKeyTYBSOQUCVOCLPN-GFCCVEGCSA-N
MW212.34 g/mol
LogP1.10
Rot. Bonds3

About (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine

(3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine (PubChem CID 86323316) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine.

Molecular Properties

Compound Name(3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine
PubChem CID86323316
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name(3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine
SMILESCN(CC1CCOCC1)[C@@H]1CCCNC1
InChIInChI=1S/C12H24N2O/c1-14(12-3-2-6-13-9-12)10-11-4-7-15-8-5-11/h11-13H,2-10H2,1H3/t12-/m1/s1
InChIKeyTYBSOQUCVOCLPN-GFCCVEGCSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(piperidin-3-ylmethyl)oxan-4-amine
CID 43611345
N-(cyclobutylmethyl)-N-methylazepan-3-amine
CID 62855304
N-methyl-N-(oxan-4-ylmethyl)cyclopropanamine
CID 70661195
N,5-dimethyl-N-(oxan-4-ylmethyl)piperidin-3-amine
CID 115373511
N-methyl-N-(oxan-4-ylmethyl)-3-piperidin-3-ylpropanamide
CID 63706973
(3S)-N-methyl-N-(oxan-4-ylmethyl)piperidine-3-carboxamide
CID 81140981
N-ethyl-N-(oxan-4-ylmethyl)pyrrolidin-3-amine
CID 63299374
N-(oxolan-3-ylmethyl)-N-propylpiperidin-3-amine
CID 63638803
N-methyl-2-(oxan-4-yl)-N-(piperidin-3-ylmethyl)ethanamine
CID 115209752
N,3-dimethyl-N-(piperidin-3-ylmethyl)cyclohexan-1-amine
CID 61447317
N-methyl-N-(piperidin-4-ylmethyl)azetidin-3-amine
CID 131110831
N-methyl-N-(2-methylpropyl)piperidin-3-amine
CID 43317078

Frequently Asked Questions

What is the IUPAC name of (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine?
The IUPAC name of (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine (CID 86323316) is (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine.
What is the SMILES notation for (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine?
The canonical SMILES for (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine is CN(CC1CCOCC1)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine?
The InChIKey is TYBSOQUCVOCLPN-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H24N2O/c1-14(12-3-2-6-13-9-12)10-11-4-7-15-8-5-11/h11-13H,2-10H2,1H3/t12-/m1/s1.
What are the key properties of (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine?
(3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine has a molecular weight of 212.34 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-methyl-N-(oxan-4-ylmethyl)piperidin-3-amine is sourced from PubChem (CID 86323316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).