2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one

C17H14N4O — CID 44632840

IUPAC2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
SMILESNc1ncc2c(n1)NC(=O)C(c1cccc3ccccc13)C2
InChIInChI=1S/C17H14N4O/c18-17-19-9-11-8-14(16(22)20-15(11)21-17)13-7-3-5-10-4-1-2-6-12(10)13/h1-7,9,14H,8H2,(H3,18,19,20,21,22)
InChIKeySYHSANFRACAPCT-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.49
Rot. Bonds1

About 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one

2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one (PubChem CID 44632840) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
PubChem CID44632840
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
SMILESNc1ncc2c(n1)NC(=O)C(c1cccc3ccccc13)C2
InChIInChI=1S/C17H14N4O/c18-17-19-9-11-8-14(16(22)20-15(11)21-17)13-7-3-5-10-4-1-2-6-12(10)13/h1-7,9,14H,8H2,(H3,18,19,20,21,22)
InChIKeySYHSANFRACAPCT-UHFFFAOYSA-N
XLogP2.49
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one (CID 44632840) is 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one is Nc1ncc2c(n1)NC(=O)C(c1cccc3ccccc13)C2.
What is the InChIKey of 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is SYHSANFRACAPCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c18-17-19-9-11-8-14(16(22)20-15(11)21-17)13-7-3-5-10-4-1-2-6-12(10)13/h1-7,9,14H,8H2,(H3,18,19,20,21,22).
What are the key properties of 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one?
2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 290.33 g/mol, XLogP of 2.49, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-naphthalen-1-yl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 44632840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).