N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide

C9H16N2O2 — CID 10176413

IUPACN-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NC(N)=O)C1(C)C
InChIInChI=1S/C9H16N2O2/c1-8(2)5(9(8,3)4)6(12)11-7(10)13/h5H,1-4H3,(H3,10,11,12,13)
InChIKeyKJBMJZDWDYSUGY-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.86
Rot. Bonds1

About N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide

N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide (PubChem CID 10176413) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide
PubChem CID10176413
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide
SMILESCC1(C)C(C(=O)NC(N)=O)C1(C)C
InChIInChI=1S/C9H16N2O2/c1-8(2)5(9(8,3)4)6(12)11-7(10)13/h5H,1-4H3,(H3,10,11,12,13)
InChIKeyKJBMJZDWDYSUGY-UHFFFAOYSA-N
XLogP0.86
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The IUPAC name of N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide (CID 10176413) is N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide.
What is the SMILES notation for N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The canonical SMILES for N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide is CC1(C)C(C(=O)NC(N)=O)C1(C)C.
What is the InChIKey of N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
The InChIKey is KJBMJZDWDYSUGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-8(2)5(9(8,3)4)6(12)11-7(10)13/h5H,1-4H3,(H3,10,11,12,13).
What are the key properties of N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide?
N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide has a molecular weight of 184.24 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2,2,3,3-tetramethylcyclopropane-1-carboxamide is sourced from PubChem (CID 10176413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).