1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine

C13H26N2O — CID 43665432

IUPAC1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine
SMILESCC1CN(C)C(C)CC1NCC1CCCO1
InChIInChI=1S/C13H26N2O/c1-10-9-15(3)11(2)7-13(10)14-8-12-5-4-6-16-12/h10-14H,4-9H2,1-3H3
InChIKeyDMPKCBRDQSIQEM-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.48
Rot. Bonds3

About 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine

1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine (PubChem CID 43665432) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine
PubChem CID43665432
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine
SMILESCC1CN(C)C(C)CC1NCC1CCCO1
InChIInChI=1S/C13H26N2O/c1-10-9-15(3)11(2)7-13(10)14-8-12-5-4-6-16-12/h10-14H,4-9H2,1-3H3
InChIKeyDMPKCBRDQSIQEM-UHFFFAOYSA-N
XLogP1.48
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-ethyloxolan-3-yl)methyl]-1,2,5-trimethylpiperidin-4-amine
CID 114105151
2,4-dimethyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 63995122
2,3-dimethyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
CID 64908944
2,5-dimethyl-N-(oxan-2-ylmethyl)cyclohexan-1-amine
CID 64761101
(2R,3R)-2-methyl-N-[[(2S)-oxolan-2-yl]methyl]oxolan-3-amine
CID 97358136
3-[[(1,2,5-trimethylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 103785859
(2S,6S)-2,6-dimethyl-N-[[(2S)-oxolan-2-yl]methyl]oxan-4-amine
CID 97358325
2-methyl-N-(oxan-2-ylmethyl)cyclopentan-1-amine
CID 63278391
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665501
1,2,5-trimethyl-N-(2-methyloxan-4-yl)piperidin-4-amine
CID 113349438
N-(2,6-dimethylpiperidin-1-yl)-1,2,5-trimethylpiperidin-4-amine
CID 83007709
2-[[(2R,4S,5R)-1,2,5-trimethylpiperidin-4-yl]amino]ethanol
CID 93258534

Frequently Asked Questions

What is the IUPAC name of 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine?
The IUPAC name of 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine (CID 43665432) is 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine.
What is the SMILES notation for 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine?
The canonical SMILES for 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine is CC1CN(C)C(C)CC1NCC1CCCO1.
What is the InChIKey of 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine?
The InChIKey is DMPKCBRDQSIQEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-10-9-15(3)11(2)7-13(10)14-8-12-5-4-6-16-12/h10-14H,4-9H2,1-3H3.
What are the key properties of 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine?
1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine has a molecular weight of 226.36 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,5-trimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 43665432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).