2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine

C16H17N5O — CID 167626151

IUPAC2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine
SMILESCc1ncc(Oc2c(C(C)C)cnc3cnccc23)c(N)n1
InChIInChI=1S/C16H17N5O/c1-9(2)12-6-20-13-7-18-5-4-11(13)15(12)22-14-8-19-10(3)21-16(14)17/h4-9H,1-3H3,(H2,17,19,21)
InChIKeyKEDJGLWJAFSWRR-UHFFFAOYSA-N
MW295.35 g/mol
LogP3.23
Rot. Bonds3

About 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine

2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine (PubChem CID 167626151) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine
PubChem CID167626151
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine
SMILESCc1ncc(Oc2c(C(C)C)cnc3cnccc23)c(N)n1
InChIInChI=1S/C16H17N5O/c1-9(2)12-6-20-13-7-18-5-4-11(13)15(12)22-14-8-19-10(3)21-16(14)17/h4-9H,1-3H3,(H2,17,19,21)
InChIKeyKEDJGLWJAFSWRR-UHFFFAOYSA-N
XLogP3.23
TPSA86.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-5-[(2-methylselanyl-5-propan-2-yl-4-pyridinyl)oxy]pyrimidin-4-amine
CID 158850448
5-(5-propan-2-ylthieno[2,3-b]pyridin-4-yl)oxypyrimidine-2,4-diamine
CID 166005304
5-(1-methyl-5-propan-2-ylpyrrolo[2,3-b]pyridin-4-yl)oxypyrimidine-2,4-diamine
CID 166005296
5-[[2-[cyclopropyl(methyl)amino]-5-propan-2-yl-4-pyridinyl]oxy]-2-methylpyrimidin-4-amine
CID 159145940
5-[4-methoxy-5-(1-methoxyethyl)-2-propan-2-ylphenoxy]-2-methylpyrimidin-4-amine
CID 147984735
2-methyl-5-(4-methyl-2-propan-2-ylphenoxy)pyrimidin-4-amine;2-(4-methyl-2-propan-2-ylphenoxy)acetonitrile
CID 159163664
[4-(4-amino-2-methylpyrimidin-5-yl)oxy-5-propan-2-yl-2-pyridinyl]urea
CID 158445340
5-[(5-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-4-yl)oxy]pyrimidine-2,4-diamine
CID 155378627
5-(5-methyl-3-propan-2-ylnaphthalen-2-yl)oxypyrimidine-2,4-diamine
CID 58826988
5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine
CID 158874276
2-methyl-4-(2-methylpyrimidin-4-yl)oxy-5-propan-2-ylaniline
CID 65216802
1-[5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-4-propan-2-ylphenyl]-3-ethylurea
CID 160731462

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine?
The IUPAC name of 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine (CID 167626151) is 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine?
The canonical SMILES for 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine is Cc1ncc(Oc2c(C(C)C)cnc3cnccc23)c(N)n1.
What is the InChIKey of 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine?
The InChIKey is KEDJGLWJAFSWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-9(2)12-6-20-13-7-18-5-4-11(13)15(12)22-14-8-19-10(3)21-16(14)17/h4-9H,1-3H3,(H2,17,19,21).
What are the key properties of 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine?
2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine has a molecular weight of 295.35 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[(3-propan-2-yl-1,7-naphthyridin-4-yl)oxy]pyrimidin-4-amine is sourced from PubChem (CID 167626151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).