2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine

C14H30N2O — CID 106675663

IUPAC2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine
SMILESCOC(C)(C)CC(CN)N1CCC(C)CC1C
InChIInChI=1S/C14H30N2O/c1-11-6-7-16(12(2)8-11)13(10-15)9-14(3,4)17-5/h11-13H,6-10,15H2,1-5H3
InChIKeyROGWTRBIZNAWLC-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.25
Rot. Bonds5

About 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine

2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine (PubChem CID 106675663) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine.

Molecular Properties

Compound Name2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine
PubChem CID106675663
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine
SMILESCOC(C)(C)CC(CN)N1CCC(C)CC1C
InChIInChI=1S/C14H30N2O/c1-11-6-7-16(12(2)8-11)13(10-15)9-14(3,4)17-5/h11-13H,6-10,15H2,1-5H3
InChIKeyROGWTRBIZNAWLC-UHFFFAOYSA-N
XLogP2.25
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dimethylpiperidin-1-yl)-3,3,3-trifluoropropan-1-amine
CID 62332099
4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine
CID 106675843
(2R,4R)-2,4-dimethyl-1-propan-2-ylpiperidine
CID 176766721
(2S,4R)-2,4-dimethyl-1-propan-2-ylpiperidine
CID 177325259
2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine
CID 103225963
(4-methyl-1-propan-2-ylpiperidin-2-yl)methanamine
CID 103440582
4-methoxy-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-1-amine
CID 106675754
2-(4-tert-butylazepan-1-yl)-4-methoxy-4-methylpentan-1-amine
CID 106675715
2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxypropan-1-amine
CID 103227319
[4-methyl-1-(3-methylbutan-2-yl)piperidin-2-yl]methanamine
CID 103440507
4-(2,4-dimethylpiperidin-1-yl)pentan-2-amine
CID 64708883
2-(2,4-dimethylpiperidin-1-yl)-2-(oxan-4-yl)ethanamine
CID 62386327

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine?
The IUPAC name of 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine (CID 106675663) is 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine.
What is the SMILES notation for 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine?
The canonical SMILES for 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine is COC(C)(C)CC(CN)N1CCC(C)CC1C.
What is the InChIKey of 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine?
The InChIKey is ROGWTRBIZNAWLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-11-6-7-16(12(2)8-11)13(10-15)9-14(3,4)17-5/h11-13H,6-10,15H2,1-5H3.
What are the key properties of 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine?
2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine is sourced from PubChem (CID 106675663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).