N-(2-adamantyl)-2-aminoacetamide

C12H20N2O — CID 43222209

IUPACN-(2-adamantyl)-2-aminoacetamide
SMILESNCC(=O)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C12H20N2O/c13-6-11(15)14-12-9-2-7-1-8(4-9)5-10(12)3-7/h7-10,12H,1-6,13H2,(H,14,15)
InChIKeyWTAFRPKCOQMNSA-UHFFFAOYSA-N
MW208.30 g/mol
LogP0.89
Rot. Bonds2

About N-(2-adamantyl)-2-aminoacetamide

N-(2-adamantyl)-2-aminoacetamide (PubChem CID 43222209) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is N-(2-adamantyl)-2-aminoacetamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-aminoacetamide
PubChem CID43222209
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC NameN-(2-adamantyl)-2-aminoacetamide
SMILESNCC(=O)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C12H20N2O/c13-6-11(15)14-12-9-2-7-1-8(4-9)5-10(12)3-7/h7-10,12H,1-6,13H2,(H,14,15)
InChIKeyWTAFRPKCOQMNSA-UHFFFAOYSA-N
XLogP0.89
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-aminoacetamide?
The IUPAC name of N-(2-adamantyl)-2-aminoacetamide (CID 43222209) is N-(2-adamantyl)-2-aminoacetamide.
What is the SMILES notation for N-(2-adamantyl)-2-aminoacetamide?
The canonical SMILES for N-(2-adamantyl)-2-aminoacetamide is NCC(=O)NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(2-adamantyl)-2-aminoacetamide?
The InChIKey is WTAFRPKCOQMNSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c13-6-11(15)14-12-9-2-7-1-8(4-9)5-10(12)3-7/h7-10,12H,1-6,13H2,(H,14,15).
What are the key properties of N-(2-adamantyl)-2-aminoacetamide?
N-(2-adamantyl)-2-aminoacetamide has a molecular weight of 208.30 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-aminoacetamide is sourced from PubChem (CID 43222209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).