N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide

C12H24N2O — CID 71197807

IUPACN-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1(CC(C)(C)C)C(=O)NCCN
InChIInChI=1S/C12H24N2O/c1-9-7-12(9,8-11(2,3)4)10(15)14-6-5-13/h9H,5-8,13H2,1-4H3,(H,14,15)
InChIKeyWVRZCLBQHPPRRB-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.52
Rot. Bonds4

About N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide

N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide (PubChem CID 71197807) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide
PubChem CID71197807
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1(CC(C)(C)C)C(=O)NCCN
InChIInChI=1S/C12H24N2O/c1-9-7-12(9,8-11(2,3)4)10(15)14-6-5-13/h9H,5-8,13H2,1-4H3,(H,14,15)
InChIKeyWVRZCLBQHPPRRB-UHFFFAOYSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide (CID 71197807) is N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide is CC1CC1(CC(C)(C)C)C(=O)NCCN.
What is the InChIKey of N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide?
The InChIKey is WVRZCLBQHPPRRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9-7-12(9,8-11(2,3)4)10(15)14-6-5-13/h9H,5-8,13H2,1-4H3,(H,14,15).
What are the key properties of N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide?
N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide has a molecular weight of 212.34 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1-(2,2-dimethylpropyl)-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 71197807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).