1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine

C18H32N2 — CID 115305138

IUPAC1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(CC23CC4CC(CC(C4)C2)C3)CC1
InChIInChI=1S/C18H32N2/c1-17(19-2)3-5-20(6-4-17)13-18-10-14-7-15(11-18)9-16(8-14)12-18/h14-16,19H,3-13H2,1-2H3
InChIKeyYSXJQMFMNKTZLF-UHFFFAOYSA-N
MW276.47 g/mol
LogP3.28
Rot. Bonds3

About 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine

1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine (PubChem CID 115305138) has the molecular formula C18H32N2 and a molecular weight of 276.47 g/mol. Its IUPAC name is 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine
PubChem CID115305138
Molecular FormulaC18H32N2
Molecular Weight276.47 g/mol
Exact Mass276.26
IUPAC Name1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(CC23CC4CC(CC(C4)C2)C3)CC1
InChIInChI=1S/C18H32N2/c1-17(19-2)3-5-20(6-4-17)13-18-10-14-7-15(11-18)9-16(8-14)12-18/h14-16,19H,3-13H2,1-2H3
InChIKeyYSXJQMFMNKTZLF-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.47
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,4-dimethyl-1-(oxolan-3-ylmethyl)piperidin-4-amine
CID 115303950
1-(2-cyclopropylethyl)-N,4-dimethylpiperidin-4-amine
CID 115305380
1-[1-(1-adamantylmethyl)piperidin-4-yl]ethanol
CID 106837476
4-(1-tricyclo[4.3.1.13,8]undecanylmethyl)morpholine;hydrochloride
CID 2858113
1-(1-adamantylmethyl)azetidin-3-ol
CID 63282389
N,4-dimethyl-1-(2-methylprop-2-enyl)piperidin-4-amine
CID 115305084
3-(1-adamantylmethyl)-1,8,8-trimethyl-3-azabicyclo[3.2.1]octane
CID 22923656
1-(1-adamantylmethyl)-3-aminopyrrolidine-3-carboxylic acid
CID 107324377
2-[4-methyl-4-(methylamino)piperidin-1-yl]ethanesulfonamide
CID 114385516
1-(1-adamantylmethyl)pyrrolidin-3-amine
CID 55029770
1-but-3-ynyl-N,4-dimethylpiperidin-4-amine
CID 115305025
2-[1-(1-adamantylmethyl)pyrrolidin-3-yl]ethanol
CID 114799708

Frequently Asked Questions

What is the IUPAC name of 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine?
The IUPAC name of 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine (CID 115305138) is 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine?
The canonical SMILES for 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine is CNC1(C)CCN(CC23CC4CC(CC(C4)C2)C3)CC1.
What is the InChIKey of 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine?
The InChIKey is YSXJQMFMNKTZLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2/c1-17(19-2)3-5-20(6-4-17)13-18-10-14-7-15(11-18)9-16(8-14)12-18/h14-16,19H,3-13H2,1-2H3.
What are the key properties of 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine?
1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine has a molecular weight of 276.47 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-adamantylmethyl)-N,4-dimethylpiperidin-4-amine is sourced from PubChem (CID 115305138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).