N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide

C15H24N2O2 — CID 2834604

IUPACN-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
SMILESCNC(=O)C(C)NC(=O)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C15H24N2O2/c1-9(13(18)16-2)17-14(19)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyGMDJLCHDIZKTKE-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.45
Rot. Bonds3

About N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide

N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide (PubChem CID 2834604) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide.

Molecular Properties

Compound NameN-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
PubChem CID2834604
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
SMILESCNC(=O)C(C)NC(=O)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C15H24N2O2/c1-9(13(18)16-2)17-14(19)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyGMDJLCHDIZKTKE-UHFFFAOYSA-N
XLogP1.45
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide?
The IUPAC name of N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide (CID 2834604) is N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide.
What is the SMILES notation for N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide?
The canonical SMILES for N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide is CNC(=O)C(C)NC(=O)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide?
The InChIKey is GMDJLCHDIZKTKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-9(13(18)16-2)17-14(19)15-6-10-3-11(7-15)5-12(4-10)8-15/h9-12H,3-8H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide?
N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide is sourced from PubChem (CID 2834604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).