4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine

C10H16N4 — CID 80774806

IUPAC4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine
SMILESCCNc1cc(N(C)C2CC2)ncn1
InChIInChI=1S/C10H16N4/c1-3-11-9-6-10(13-7-12-9)14(2)8-4-5-8/h6-8H,3-5H2,1-2H3,(H,11,12,13)
InChIKeySDALBDKWCXSQLW-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.51
Rot. Bonds4

About 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine

4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine (PubChem CID 80774806) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine
PubChem CID80774806
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine
SMILESCCNc1cc(N(C)C2CC2)ncn1
InChIInChI=1S/C10H16N4/c1-3-11-9-6-10(13-7-12-9)14(2)8-4-5-8/h6-8H,3-5H2,1-2H3,(H,11,12,13)
InChIKeySDALBDKWCXSQLW-UHFFFAOYSA-N
XLogP1.51
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine (CID 80774806) is 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine is CCNc1cc(N(C)C2CC2)ncn1.
What is the InChIKey of 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine?
The InChIKey is SDALBDKWCXSQLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-3-11-9-6-10(13-7-12-9)14(2)8-4-5-8/h6-8H,3-5H2,1-2H3,(H,11,12,13).
What are the key properties of 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine?
4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine has a molecular weight of 192.27 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopropyl-6-N-ethyl-4-N-methylpyrimidine-4,6-diamine is sourced from PubChem (CID 80774806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).