N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine

C13H18N4 — CID 20604253

IUPACN,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine
SMILESCC(C)Nc1nc(C(C)C)nc2cccnc12
InChIInChI=1S/C13H18N4/c1-8(2)12-16-10-6-5-7-14-11(10)13(17-12)15-9(3)4/h5-9H,1-4H3,(H,15,16,17)
InChIKeyQQMYPPJINICUIK-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.97
Rot. Bonds3

About N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine

N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine (PubChem CID 20604253) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine
PubChem CID20604253
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC NameN,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine
SMILESCC(C)Nc1nc(C(C)C)nc2cccnc12
InChIInChI=1S/C13H18N4/c1-8(2)12-16-10-6-5-7-14-11(10)13(17-12)15-9(3)4/h5-9H,1-4H3,(H,15,16,17)
InChIKeyQQMYPPJINICUIK-UHFFFAOYSA-N
XLogP2.97
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine?
The IUPAC name of N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine (CID 20604253) is N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine?
The canonical SMILES for N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine is CC(C)Nc1nc(C(C)C)nc2cccnc12.
What is the InChIKey of N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine?
The InChIKey is QQMYPPJINICUIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-8(2)12-16-10-6-5-7-14-11(10)13(17-12)15-9(3)4/h5-9H,1-4H3,(H,15,16,17).
What are the key properties of N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine?
N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine has a molecular weight of 230.31 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-di(propan-2-yl)pyrido[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 20604253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).