1-(2-morpholin-4-ylethyl)-2-propylguanidine

C10H22N4O — CID 62361957

IUPAC1-(2-morpholin-4-ylethyl)-2-propylguanidine
SMILESCCC/N=C(\N)NCCN1CCOCC1
InChIInChI=1S/C10H22N4O/c1-2-3-12-10(11)13-4-5-14-6-8-15-9-7-14/h2-9H2,1H3,(H3,11,12,13)
InChIKeyQXUDVZRSUANWFX-UHFFFAOYSA-N
MW214.31 g/mol
LogP-0.37
Rot. Bonds5

About 1-(2-morpholin-4-ylethyl)-2-propylguanidine

1-(2-morpholin-4-ylethyl)-2-propylguanidine (PubChem CID 62361957) has the molecular formula C10H22N4O and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-2-propylguanidine.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-2-propylguanidine
PubChem CID62361957
Molecular FormulaC10H22N4O
Molecular Weight214.31 g/mol
Exact Mass214.18
IUPAC Name1-(2-morpholin-4-ylethyl)-2-propylguanidine
SMILESCCC/N=C(\N)NCCN1CCOCC1
InChIInChI=1S/C10H22N4O/c1-2-3-12-10(11)13-4-5-14-6-8-15-9-7-14/h2-9H2,1H3,(H3,11,12,13)
InChIKeyQXUDVZRSUANWFX-UHFFFAOYSA-N
XLogP-0.37
TPSA62.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-2-propylguanidine?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-2-propylguanidine (CID 62361957) is 1-(2-morpholin-4-ylethyl)-2-propylguanidine.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-2-propylguanidine?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-2-propylguanidine is CCC/N=C(\N)NCCN1CCOCC1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-2-propylguanidine?
The InChIKey is QXUDVZRSUANWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O/c1-2-3-12-10(11)13-4-5-14-6-8-15-9-7-14/h2-9H2,1H3,(H3,11,12,13).
What are the key properties of 1-(2-morpholin-4-ylethyl)-2-propylguanidine?
1-(2-morpholin-4-ylethyl)-2-propylguanidine has a molecular weight of 214.31 g/mol, XLogP of -0.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-2-propylguanidine is sourced from PubChem (CID 62361957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).