N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide

C14H24N2O2 — CID 142221310

IUPACN-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide
SMILESCC1(C)C2CCC(C2)C1CCC(=O)NCC(N)=O
InChIInChI=1S/C14H24N2O2/c1-14(2)10-4-3-9(7-10)11(14)5-6-13(18)16-8-12(15)17/h9-11H,3-8H2,1-2H3,(H2,15,17)(H,16,18)
InChIKeyANQGNQQYUZBKTO-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.44
Rot. Bonds5

About N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide

N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide (PubChem CID 142221310) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide
PubChem CID142221310
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide
SMILESCC1(C)C2CCC(C2)C1CCC(=O)NCC(N)=O
InChIInChI=1S/C14H24N2O2/c1-14(2)10-4-3-9(7-10)11(14)5-6-13(18)16-8-12(15)17/h9-11H,3-8H2,1-2H3,(H2,15,17)(H,16,18)
InChIKeyANQGNQQYUZBKTO-UHFFFAOYSA-N
XLogP1.44
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide (CID 142221310) is N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide is CC1(C)C2CCC(C2)C1CCC(=O)NCC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide?
The InChIKey is ANQGNQQYUZBKTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-14(2)10-4-3-9(7-10)11(14)5-6-13(18)16-8-12(15)17/h9-11H,3-8H2,1-2H3,(H2,15,17)(H,16,18).
What are the key properties of N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide?
N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide has a molecular weight of 252.36 g/mol, XLogP of 1.44, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-3-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)propanamide is sourced from PubChem (CID 142221310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).