4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine

C15H32N2O — CID 106675843

IUPAC4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine
SMILESCOC(C)(C)CC(CN)N1CCC(C(C)C)CC1
InChIInChI=1S/C15H32N2O/c1-12(2)13-6-8-17(9-7-13)14(11-16)10-15(3,4)18-5/h12-14H,6-11,16H2,1-5H3
InChIKeyIEGSQJURAQWVPK-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.50
Rot. Bonds6

About 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine

4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine (PubChem CID 106675843) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine.

Molecular Properties

Compound Name4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine
PubChem CID106675843
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine
SMILESCOC(C)(C)CC(CN)N1CCC(C(C)C)CC1
InChIInChI=1S/C15H32N2O/c1-12(2)13-6-8-17(9-7-13)14(11-16)10-15(3,4)18-5/h12-14H,6-11,16H2,1-5H3
InChIKeyIEGSQJURAQWVPK-UHFFFAOYSA-N
XLogP2.50
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-tert-butylazepan-1-yl)-4-methoxy-4-methylpentan-1-amine
CID 106675715
4-methoxy-4-methyl-2-(4-propylpiperazin-1-yl)pentan-1-amine
CID 106675511
4-methoxy-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-1-amine
CID 106675754
2-(2,4-dimethylpiperidin-1-yl)-4-methoxy-4-methylpentan-1-amine
CID 106675663
2-(4-methoxypiperidin-1-yl)butan-1-amine
CID 43372672
1-[1-(1-aminobutan-2-yl)piperidin-4-yl]ethanol
CID 106835618
4-amino-N,N-dimethyl-3-(4-propan-2-ylpiperidin-1-yl)butanamide
CID 103494590
4-amino-3-(4-propan-2-ylazepan-1-yl)butanamide
CID 66426900
2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-4-methoxy-4-methylpentan-1-amine
CID 106675718
tert-butyl N-[3-amino-2-(3-propan-2-ylpyrrolidin-1-yl)propyl]carbamate
CID 102730438
5-methylsulfanyl-2-(3-propan-2-ylpyrrolidin-1-yl)pentan-1-amine
CID 103089049
2-(4-propan-2-ylpiperidin-1-yl)pentan-3-amine
CID 103495147

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine?
The IUPAC name of 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine (CID 106675843) is 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine.
What is the SMILES notation for 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine?
The canonical SMILES for 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine is COC(C)(C)CC(CN)N1CCC(C(C)C)CC1.
What is the InChIKey of 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine?
The InChIKey is IEGSQJURAQWVPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-12(2)13-6-8-17(9-7-13)14(11-16)10-15(3,4)18-5/h12-14H,6-11,16H2,1-5H3.
What are the key properties of 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine?
4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine has a molecular weight of 256.43 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-4-methyl-2-(4-propan-2-ylpiperidin-1-yl)pentan-1-amine is sourced from PubChem (CID 106675843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).