N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine

C15H28N2O — CID 55030735

IUPACN-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCC1(C)CC(NCC2CCC=CO2)CC(C)(C)N1
InChIInChI=1S/C15H28N2O/c1-14(2)9-12(10-15(3,4)17-14)16-11-13-7-5-6-8-18-13/h6,8,12-13,16-17H,5,7,9-11H2,1-4H3
InChIKeyBTJGGQKEEQEKEY-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.58
Rot. Bonds3

About N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine

N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine (PubChem CID 55030735) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine
PubChem CID55030735
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCC1(C)CC(NCC2CCC=CO2)CC(C)(C)N1
InChIInChI=1S/C15H28N2O/c1-14(2)9-12(10-15(3,4)17-14)16-11-13-7-5-6-8-18-13/h6,8,12-13,16-17H,5,7,9-11H2,1-4H3
InChIKeyBTJGGQKEEQEKEY-UHFFFAOYSA-N
XLogP2.58
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine?
The IUPAC name of N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine (CID 55030735) is N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine.
What is the SMILES notation for N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine?
The canonical SMILES for N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine is CC1(C)CC(NCC2CCC=CO2)CC(C)(C)N1.
What is the InChIKey of N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine?
The InChIKey is BTJGGQKEEQEKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-14(2)9-12(10-15(3,4)17-14)16-11-13-7-5-6-8-18-13/h6,8,12-13,16-17H,5,7,9-11H2,1-4H3.
What are the key properties of N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine?
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine has a molecular weight of 252.40 g/mol, XLogP of 2.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-pyran-2-ylmethyl)-2,2,6,6-tetramethylpiperidin-4-amine is sourced from PubChem (CID 55030735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).