N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide

C9H16N2O — CID 61350147

IUPACN-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide
SMILESNCCN(C(=O)C1CC1)C1CC1
InChIInChI=1S/C9H16N2O/c10-5-6-11(8-3-4-8)9(12)7-1-2-7/h7-8H,1-6,10H2
InChIKeyPRITVELPMQTAKI-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.35
Rot. Bonds4

About N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide

N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide (PubChem CID 61350147) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide
PubChem CID61350147
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC NameN-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide
SMILESNCCN(C(=O)C1CC1)C1CC1
InChIInChI=1S/C9H16N2O/c10-5-6-11(8-3-4-8)9(12)7-1-2-7/h7-8H,1-6,10H2
InChIKeyPRITVELPMQTAKI-UHFFFAOYSA-N
XLogP0.35
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.35
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-cyclopropylcyclopropanecarboxamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide (CID 61350147) is N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide is NCCN(C(=O)C1CC1)C1CC1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide?
The InChIKey is PRITVELPMQTAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c10-5-6-11(8-3-4-8)9(12)7-1-2-7/h7-8H,1-6,10H2.
What are the key properties of N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide?
N-(2-aminoethyl)-N-cyclopropylcyclopropanecarboxamide has a molecular weight of 168.24 g/mol, XLogP of 0.35, 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-cyclopropylcyclopropanecarboxamide is sourced from PubChem (CID 61350147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).