6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine

C15H21N5 — CID 154823543

IUPAC6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine
SMILESCCCN1CCC(Nc2ncnc3ccc(C)nc23)C1
InChIInChI=1S/C15H21N5/c1-3-7-20-8-6-12(9-20)19-15-14-13(16-10-17-15)5-4-11(2)18-14/h4-5,10,12H,3,6-9H2,1-2H3,(H,16,17,19)
InChIKeyPMVQMPZYYBROHM-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.23
Rot. Bonds4

About 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine

6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine (PubChem CID 154823543) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine
PubChem CID154823543
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine
SMILESCCCN1CCC(Nc2ncnc3ccc(C)nc23)C1
InChIInChI=1S/C15H21N5/c1-3-7-20-8-6-12(9-20)19-15-14-13(16-10-17-15)5-4-11(2)18-14/h4-5,10,12H,3,6-9H2,1-2H3,(H,16,17,19)
InChIKeyPMVQMPZYYBROHM-UHFFFAOYSA-N
XLogP2.23
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine?
The IUPAC name of 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine (CID 154823543) is 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine is CCCN1CCC(Nc2ncnc3ccc(C)nc23)C1.
What is the InChIKey of 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine?
The InChIKey is PMVQMPZYYBROHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-3-7-20-8-6-12(9-20)19-15-14-13(16-10-17-15)5-4-11(2)18-14/h4-5,10,12H,3,6-9H2,1-2H3,(H,16,17,19).
What are the key properties of 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine?
6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine has a molecular weight of 271.37 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(1-propylpyrrolidin-3-yl)pyrido[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 154823543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).