6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine

C10H16N4O — CID 66732211

IUPAC6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
SMILESCNc1cc(NCC2CCCO2)ncn1
InChIInChI=1S/C10H16N4O/c1-11-9-5-10(14-7-13-9)12-6-8-3-2-4-15-8/h5,7-8H,2-4,6H2,1H3,(H2,11,12,13,14)
InChIKeyUKUWPBXWVZETPM-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.11
Rot. Bonds4

About 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine

6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine (PubChem CID 66732211) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
PubChem CID66732211
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine
SMILESCNc1cc(NCC2CCCO2)ncn1
InChIInChI=1S/C10H16N4O/c1-11-9-5-10(14-7-13-9)12-6-8-3-2-4-15-8/h5,7-8H,2-4,6H2,1H3,(H2,11,12,13,14)
InChIKeyUKUWPBXWVZETPM-UHFFFAOYSA-N
XLogP1.11
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine?
The IUPAC name of 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine (CID 66732211) is 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine?
The canonical SMILES for 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine is CNc1cc(NCC2CCCO2)ncn1.
What is the InChIKey of 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine?
The InChIKey is UKUWPBXWVZETPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-11-9-5-10(14-7-13-9)12-6-8-3-2-4-15-8/h5,7-8H,2-4,6H2,1H3,(H2,11,12,13,14).
What are the key properties of 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine?
6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine has a molecular weight of 208.26 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-methyl-4-N-(oxolan-2-ylmethyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 66732211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).