(1-ethoxycyclopropyl)-piperazin-1-ylmethanone

C10H18N2O2 — CID 155895636

IUPAC(1-ethoxycyclopropyl)-piperazin-1-ylmethanone
SMILESCCOC1(C(=O)N2CCNCC2)CC1
InChIInChI=1S/C10H18N2O2/c1-2-14-10(3-4-10)9(13)12-7-5-11-6-8-12/h11H,2-8H2,1H3
InChIKeyHPOHUBJWCIGDNX-UHFFFAOYSA-N
MW198.27 g/mol
LogP-0.01
Rot. Bonds3

About (1-ethoxycyclopropyl)-piperazin-1-ylmethanone

(1-ethoxycyclopropyl)-piperazin-1-ylmethanone (PubChem CID 155895636) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is (1-ethoxycyclopropyl)-piperazin-1-ylmethanone.

Molecular Properties

Compound Name(1-ethoxycyclopropyl)-piperazin-1-ylmethanone
PubChem CID155895636
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name(1-ethoxycyclopropyl)-piperazin-1-ylmethanone
SMILESCCOC1(C(=O)N2CCNCC2)CC1
InChIInChI=1S/C10H18N2O2/c1-2-14-10(3-4-10)9(13)12-7-5-11-6-8-12/h11H,2-8H2,1H3
InChIKeyHPOHUBJWCIGDNX-UHFFFAOYSA-N
XLogP-0.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-ethoxycyclopropyl)-piperazin-1-ylmethanone?
The IUPAC name of (1-ethoxycyclopropyl)-piperazin-1-ylmethanone (CID 155895636) is (1-ethoxycyclopropyl)-piperazin-1-ylmethanone.
What is the SMILES notation for (1-ethoxycyclopropyl)-piperazin-1-ylmethanone?
The canonical SMILES for (1-ethoxycyclopropyl)-piperazin-1-ylmethanone is CCOC1(C(=O)N2CCNCC2)CC1.
What is the InChIKey of (1-ethoxycyclopropyl)-piperazin-1-ylmethanone?
The InChIKey is HPOHUBJWCIGDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-2-14-10(3-4-10)9(13)12-7-5-11-6-8-12/h11H,2-8H2,1H3.
What are the key properties of (1-ethoxycyclopropyl)-piperazin-1-ylmethanone?
(1-ethoxycyclopropyl)-piperazin-1-ylmethanone has a molecular weight of 198.27 g/mol, XLogP of -0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxycyclopropyl)-piperazin-1-ylmethanone is sourced from PubChem (CID 155895636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).