(2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine

C9H10N4 — CID 82411430

IUPAC(2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine
SMILESCc1ncc2ccc(CN)nc2n1
InChIInChI=1S/C9H10N4/c1-6-11-5-7-2-3-8(4-10)13-9(7)12-6/h2-3,5H,4,10H2,1H3
InChIKeyZYVCCCUWXXNMNZ-UHFFFAOYSA-N
MW174.21 g/mol
LogP0.79
Rot. Bonds1

About (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine

(2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine (PubChem CID 82411430) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine.

Molecular Properties

Compound Name(2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine
PubChem CID82411430
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name(2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine
SMILESCc1ncc2ccc(CN)nc2n1
InChIInChI=1S/C9H10N4/c1-6-11-5-7-2-3-8(4-10)13-9(7)12-6/h2-3,5H,4,10H2,1H3
InChIKeyZYVCCCUWXXNMNZ-UHFFFAOYSA-N
XLogP0.79
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine?
The IUPAC name of (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine (CID 82411430) is (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine.
What is the SMILES notation for (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine?
The canonical SMILES for (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine is Cc1ncc2ccc(CN)nc2n1.
What is the InChIKey of (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine?
The InChIKey is ZYVCCCUWXXNMNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c1-6-11-5-7-2-3-8(4-10)13-9(7)12-6/h2-3,5H,4,10H2,1H3.
What are the key properties of (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine?
(2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine has a molecular weight of 174.21 g/mol, XLogP of 0.79, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrido[2,3-d]pyrimidin-7-yl)methanamine is sourced from PubChem (CID 82411430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).