2-(2-adamantylamino)acetamide

C12H20N2O — CID 43406800

IUPAC2-(2-adamantylamino)acetamide
SMILESNC(=O)CNC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C12H20N2O/c13-11(15)6-14-12-9-2-7-1-8(4-9)5-10(12)3-7/h7-10,12,14H,1-6H2,(H2,13,15)
InChIKeyNQMCMFHTYGMRMQ-UHFFFAOYSA-N
MW208.30 g/mol
LogP0.89
Rot. Bonds3

About 2-(2-adamantylamino)acetamide

2-(2-adamantylamino)acetamide (PubChem CID 43406800) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-(2-adamantylamino)acetamide.

Molecular Properties

Compound Name2-(2-adamantylamino)acetamide
PubChem CID43406800
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name2-(2-adamantylamino)acetamide
SMILESNC(=O)CNC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C12H20N2O/c13-11(15)6-14-12-9-2-7-1-8(4-9)5-10(12)3-7/h7-10,12,14H,1-6H2,(H2,13,15)
InChIKeyNQMCMFHTYGMRMQ-UHFFFAOYSA-N
XLogP0.89
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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 2-(2-adamantylamino)acetamide?
The IUPAC name of 2-(2-adamantylamino)acetamide (CID 43406800) is 2-(2-adamantylamino)acetamide.
What is the SMILES notation for 2-(2-adamantylamino)acetamide?
The canonical SMILES for 2-(2-adamantylamino)acetamide is NC(=O)CNC1C2CC3CC(C2)CC1C3.
What is the InChIKey of 2-(2-adamantylamino)acetamide?
The InChIKey is NQMCMFHTYGMRMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c13-11(15)6-14-12-9-2-7-1-8(4-9)5-10(12)3-7/h7-10,12,14H,1-6H2,(H2,13,15).
What are the key properties of 2-(2-adamantylamino)acetamide?
2-(2-adamantylamino)acetamide has a molecular weight of 208.30 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-adamantylamino)acetamide is sourced from PubChem (CID 43406800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).