N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide

C16H26N2O — CID 2192462

IUPACN-(2-adamantyl)-2-pyrrolidin-1-ylacetamide
SMILESO=C(CN1CCCC1)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C16H26N2O/c19-15(10-18-3-1-2-4-18)17-16-13-6-11-5-12(8-13)9-14(16)7-11/h11-14,16H,1-10H2,(H,17,19)
InChIKeyJAZQNPJWFVDDDU-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.02
Rot. Bonds3

About N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide

N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide (PubChem CID 2192462) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-(2-adamantyl)-2-pyrrolidin-1-ylacetamide
PubChem CID2192462
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-(2-adamantyl)-2-pyrrolidin-1-ylacetamide
SMILESO=C(CN1CCCC1)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C16H26N2O/c19-15(10-18-3-1-2-4-18)17-16-13-6-11-5-12(8-13)9-14(16)7-11/h11-14,16H,1-10H2,(H,17,19)
InChIKeyJAZQNPJWFVDDDU-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide (CID 2192462) is N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide is O=C(CN1CCCC1)NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide?
The InChIKey is JAZQNPJWFVDDDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c19-15(10-18-3-1-2-4-18)17-16-13-6-11-5-12(8-13)9-14(16)7-11/h11-14,16H,1-10H2,(H,17,19).
What are the key properties of N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide?
N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide has a molecular weight of 262.40 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 2192462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).