N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine

C10H17N5O — CID 121204896

IUPACN'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine
SMILESNCCNc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C10H17N5O/c11-2-4-12-9-1-3-13-10(14-9)15-5-7-16-8-6-15/h1,3H,2,4-8,11H2,(H,12,13,14)
InChIKeyMCHHPYZXUZILLF-UHFFFAOYSA-N
MW223.28 g/mol
LogP-0.32
Rot. Bonds4

About N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine

N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine (PubChem CID 121204896) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine
PubChem CID121204896
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC NameN'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine
SMILESNCCNc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C10H17N5O/c11-2-4-12-9-1-3-13-10(14-9)15-5-7-16-8-6-15/h1,3H,2,4-8,11H2,(H,12,13,14)
InChIKeyMCHHPYZXUZILLF-UHFFFAOYSA-N
XLogP-0.32
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine?
The IUPAC name of N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine (CID 121204896) is N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine is NCCNc1ccnc(N2CCOCC2)n1.
What is the InChIKey of N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine?
The InChIKey is MCHHPYZXUZILLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c11-2-4-12-9-1-3-13-10(14-9)15-5-7-16-8-6-15/h1,3H,2,4-8,11H2,(H,12,13,14).
What are the key properties of N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine?
N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine has a molecular weight of 223.28 g/mol, XLogP of -0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-morpholin-4-ylpyrimidin-4-yl)ethane-1,2-diamine is sourced from PubChem (CID 121204896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).