2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine

C18H26Cl2N8O2 — CID 118892550

IUPAC2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine
SMILESClc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1
InChIInChI=1S/C18H26Cl2N8O2/c19-14-17(22-2-4-28-7-11-30-12-8-28)24-16-13(23-14)15(25-18(20)26-16)21-1-3-27-5-9-29-10-6-27/h1-12H2,(H2,21,22,24,25,26)
InChIKeyQPLIFQMETZDAGH-UHFFFAOYSA-N
MW457.37 g/mol
LogP1.21
Rot. Bonds8

About 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine

2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine (PubChem CID 118892550) has the molecular formula C18H26Cl2N8O2 and a molecular weight of 457.37 g/mol. Its IUPAC name is 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine.

Molecular Properties

Compound Name2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine
PubChem CID118892550
Molecular FormulaC18H26Cl2N8O2
Molecular Weight457.37 g/mol
Exact Mass456.16
IUPAC Name2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine
SMILESClc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1
InChIInChI=1S/C18H26Cl2N8O2/c19-14-17(22-2-4-28-7-11-30-12-8-28)24-16-13(23-14)15(25-18(20)26-16)21-1-3-27-5-9-29-10-6-27/h1-12H2,(H2,21,22,24,25,26)
InChIKeyQPLIFQMETZDAGH-UHFFFAOYSA-N
XLogP1.21
TPSA100.56 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.37
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine with MolForge

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Launch Full Analysis

Related Compounds

6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;ethane
CID 145022023
6-chloro-2-methylsulfinyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine
CID 118892576
6-chloro-2-methyl-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine;2,4,6,7-tetrachloropteridine
CID 157204411
3,6-dichloro-N-(3-morpholin-4-ylpropyl)-1,2,4-triazin-5-amine
CID 81035323
6-chloro-2-(4-methylpiperazin-1-yl)-4-N,7-N-bis[2-(4-methylpiperazin-1-yl)ethyl]pteridine-4,7-diamine
CID 118892615
6-chloro-1-methyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 58345954
4-chloro-6-methyl-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine
CID 143985982
6,7-dichloro-2-methylsulfonyl-N-(2-piperidin-1-ylethyl)pteridin-4-amine
CID 130466479
2,6-dichloro-5-cyclopentyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 88906606
3,5-dichloro-6-N-(2-morpholin-4-ylethyl)pyridine-2,6-diamine
CID 102755704
2-chloro-N-(2-morpholin-4-ylethyl)-6-propylpyrimidin-4-amine
CID 82460824
4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine
CID 145022020

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine?
The IUPAC name of 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine (CID 118892550) is 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine.
What is the SMILES notation for 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine?
The canonical SMILES for 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine is Clc1nc(NCCN2CCOCC2)c2nc(Cl)c(NCCN3CCOCC3)nc2n1.
What is the InChIKey of 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine?
The InChIKey is QPLIFQMETZDAGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26Cl2N8O2/c19-14-17(22-2-4-28-7-11-30-12-8-28)24-16-13(23-14)15(25-18(20)26-16)21-1-3-27-5-9-29-10-6-27/h1-12H2,(H2,21,22,24,25,26).
What are the key properties of 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine?
2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine has a molecular weight of 457.37 g/mol, XLogP of 1.21, 8 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-4-N,7-N-bis(2-morpholin-4-ylethyl)pteridine-4,7-diamine is sourced from PubChem (CID 118892550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).