6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine

C14H23N5O — CID 91792343

IUPAC6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
SMILESNC1CC(c2cc(NCCN3CCOCC3)ncn2)C1
InChIInChI=1S/C14H23N5O/c15-12-7-11(8-12)13-9-14(18-10-17-13)16-1-2-19-3-5-20-6-4-19/h9-12H,1-8,15H2,(H,16,17,18)
InChIKeyOCPRBTSDUOYGEU-UHFFFAOYSA-N
MW277.37 g/mol
LogP0.43
Rot. Bonds5

About 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine

6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine (PubChem CID 91792343) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
PubChem CID91792343
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
SMILESNC1CC(c2cc(NCCN3CCOCC3)ncn2)C1
InChIInChI=1S/C14H23N5O/c15-12-7-11(8-12)13-9-14(18-10-17-13)16-1-2-19-3-5-20-6-4-19/h9-12H,1-8,15H2,(H,16,17,18)
InChIKeyOCPRBTSDUOYGEU-UHFFFAOYSA-N
XLogP0.43
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The IUPAC name of 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine (CID 91792343) is 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The canonical SMILES for 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine is NC1CC(c2cc(NCCN3CCOCC3)ncn2)C1.
What is the InChIKey of 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
The InChIKey is OCPRBTSDUOYGEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c15-12-7-11(8-12)13-9-14(18-10-17-13)16-1-2-19-3-5-20-6-4-19/h9-12H,1-8,15H2,(H,16,17,18).
What are the key properties of 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine?
6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine has a molecular weight of 277.37 g/mol, XLogP of 0.43, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-aminocyclobutyl)-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine is sourced from PubChem (CID 91792343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).