4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine

C10H16N4 — CID 80933693

IUPAC4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine
SMILESCCc1nc(N)cc(N(C)C2CC2)n1
InChIInChI=1S/C10H16N4/c1-3-9-12-8(11)6-10(13-9)14(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H2,11,12,13)
InChIKeyVYXGNXMUVOGXKB-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.22
Rot. Bonds3

About 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine

4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine (PubChem CID 80933693) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine
PubChem CID80933693
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine
SMILESCCc1nc(N)cc(N(C)C2CC2)n1
InChIInChI=1S/C10H16N4/c1-3-9-12-8(11)6-10(13-9)14(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H2,11,12,13)
InChIKeyVYXGNXMUVOGXKB-UHFFFAOYSA-N
XLogP1.22
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine (CID 80933693) is 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine is CCc1nc(N)cc(N(C)C2CC2)n1.
What is the InChIKey of 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine?
The InChIKey is VYXGNXMUVOGXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-3-9-12-8(11)6-10(13-9)14(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H2,11,12,13).
What are the key properties of 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine?
4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine has a molecular weight of 192.27 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopropyl-2-ethyl-4-N-methylpyrimidine-4,6-diamine is sourced from PubChem (CID 80933693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).