4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine

C10H16N4 — CID 80769657

IUPAC4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine
SMILESCCCNc1cc(NC2CC2)ncn1
InChIInChI=1S/C10H16N4/c1-2-5-11-9-6-10(13-7-12-9)14-8-3-4-8/h6-8H,2-5H2,1H3,(H2,11,12,13,14)
InChIKeyZLUNHKBGNXZBCO-UHFFFAOYSA-N
MW192.27 g/mol
LogP1.87
Rot. Bonds5

About 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine

4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine (PubChem CID 80769657) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine
PubChem CID80769657
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine
SMILESCCCNc1cc(NC2CC2)ncn1
InChIInChI=1S/C10H16N4/c1-2-5-11-9-6-10(13-7-12-9)14-8-3-4-8/h6-8H,2-5H2,1H3,(H2,11,12,13,14)
InChIKeyZLUNHKBGNXZBCO-UHFFFAOYSA-N
XLogP1.87
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(3-ethylcyclohexyl)-6-N-propylpyrimidine-4,6-diamine
CID 80841357
4-N-cyclopropyl-6-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine
CID 112854687
4-N-cyclopropyl-6-N-[3-(dimethylamino)propyl]pyrimidine-4,6-diamine
CID 112854689
4-N-cyclohexyl-6-N-(3-methylbutyl)pyrimidine-4,6-diamine
CID 112856250
4-N-[(4-methylcyclohexyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80828903
4-N-(cyclohexylmethyl)-6-N-propylpyrimidine-4,6-diamine
CID 80784186
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
4-N-(3-cyclopentylpropyl)-6-N-propylpyrimidine-4,6-diamine
CID 106014887
4-N-(1-cyclohexylpropyl)-6-N-propylpyrimidine-4,6-diamine
CID 80827059
6-cyclobutyl-N-propylpyrimidin-4-amine
CID 126848136
4-N-(1,1-dioxothian-4-yl)-6-N-ethylpyrimidine-4,6-diamine
CID 80789316
4-N-cycloheptyl-2-ethyl-6-N-propylpyrimidine-4,6-diamine
CID 80933862

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine (CID 80769657) is 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine is CCCNc1cc(NC2CC2)ncn1.
What is the InChIKey of 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine?
The InChIKey is ZLUNHKBGNXZBCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-2-5-11-9-6-10(13-7-12-9)14-8-3-4-8/h6-8H,2-5H2,1H3,(H2,11,12,13,14).
What are the key properties of 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine?
4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine has a molecular weight of 192.27 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 80769657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).