N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide

C10H18N2O — CID 61350134

IUPACN-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)N(CCN)C1CC1
InChIInChI=1S/C10H18N2O/c1-7-6-9(7)10(13)12(5-4-11)8-2-3-8/h7-9H,2-6,11H2,1H3
InChIKeyATRCOZYYUQXRNB-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.59
Rot. Bonds4

About N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide

N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide (PubChem CID 61350134) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide
PubChem CID61350134
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)N(CCN)C1CC1
InChIInChI=1S/C10H18N2O/c1-7-6-9(7)10(13)12(5-4-11)8-2-3-8/h7-9H,2-6,11H2,1H3
InChIKeyATRCOZYYUQXRNB-UHFFFAOYSA-N
XLogP0.59
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide (CID 61350134) is N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)N(CCN)C1CC1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide?
The InChIKey is ATRCOZYYUQXRNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-7-6-9(7)10(13)12(5-4-11)8-2-3-8/h7-9H,2-6,11H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide?
N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide has a molecular weight of 182.27 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-cyclopropyl-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 61350134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).