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

C15H24N2O2 — CID 7432877

IUPACN-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
SMILESCNC(=O)[C@@H](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)/t9-,10?,11?,12?,15?/m1/s1
InChIKeyGMDJLCHDIZKTKE-XBVVOLJWSA-N
MW264.37 g/mol
LogP1.45
Rot. Bonds3

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

N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide (PubChem CID 7432877) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
PubChem CID7432877
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
SMILESCNC(=O)[C@@H](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)/t9-,10?,11?,12?,15?/m1/s1
InChIKeyGMDJLCHDIZKTKE-XBVVOLJWSA-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-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide?
The IUPAC name of N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide (CID 7432877) is N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide.
What is the SMILES notation for N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide?
The canonical SMILES for N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide is CNC(=O)[C@@H](C)NC(=O)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide?
The InChIKey is GMDJLCHDIZKTKE-XBVVOLJWSA-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)/t9-,10?,11?,12?,15?/m1/s1.
What are the key properties of N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide?
N-[(2R)-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-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide is sourced from PubChem (CID 7432877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).