6-propan-2-ylpteridine

C9H10N4 — CID 59283430

IUPAC6-propan-2-ylpteridine
SMILESCC(C)c1cnc2ncncc2n1
InChIInChI=1S/C9H10N4/c1-6(2)7-4-11-9-8(13-7)3-10-5-12-9/h3-6H,1-2H3
InChIKeyRUXWJRCTFPHHGI-UHFFFAOYSA-N
MW174.21 g/mol
LogP1.54
Rot. Bonds1

About 6-propan-2-ylpteridine

6-propan-2-ylpteridine (PubChem CID 59283430) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is 6-propan-2-ylpteridine.

Molecular Properties

Compound Name6-propan-2-ylpteridine
PubChem CID59283430
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name6-propan-2-ylpteridine
SMILESCC(C)c1cnc2ncncc2n1
InChIInChI=1S/C9H10N4/c1-6(2)7-4-11-9-8(13-7)3-10-5-12-9/h3-6H,1-2H3
InChIKeyRUXWJRCTFPHHGI-UHFFFAOYSA-N
XLogP1.54
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6,8-di(propan-2-yl)pyrido[3,2-d]pyrimidine
CID 130336662
6-(2,2-dimethylpropyl)pteridine
CID 118285087
N,N-diethylpteridin-6-amine
CID 140624646
6-propan-2-ylpyrido[3,4-d]pyrimidine
CID 59592820
2,5-di(propan-2-yl)pyrazine;2,6-di(propan-2-yl)pyrazine
CID 161386893
pteridine-6,7-diamine
CID 119097307
N-ethyl-N-trimethylsilylpteridin-6-amine
CID 140624706
2-propan-2-yl-[1,3]thiazolo[5,4-d]pyrimidine
CID 58470040
6-(4-fluorophenyl)pteridine
CID 175699654
7-nitroso-6-propan-2-ylpyrido[2,3-d]pyrimidine
CID 155057011
3,5-di(propan-2-yl)-2H-pyrazolo[3,4-b]pyrazine
CID 138701227
formaldehyde;bis(pteridine)
CID 174932722

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylpteridine?
The IUPAC name of 6-propan-2-ylpteridine (CID 59283430) is 6-propan-2-ylpteridine.
What is the SMILES notation for 6-propan-2-ylpteridine?
The canonical SMILES for 6-propan-2-ylpteridine is CC(C)c1cnc2ncncc2n1.
What is the InChIKey of 6-propan-2-ylpteridine?
The InChIKey is RUXWJRCTFPHHGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c1-6(2)7-4-11-9-8(13-7)3-10-5-12-9/h3-6H,1-2H3.
What are the key properties of 6-propan-2-ylpteridine?
6-propan-2-ylpteridine has a molecular weight of 174.21 g/mol, XLogP of 1.54, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylpteridine is sourced from PubChem (CID 59283430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).