N-propyl-4-quinolin-7-ylpyrimidin-2-amine

C16H16N4 — CID 81221832

IUPACN-propyl-4-quinolin-7-ylpyrimidin-2-amine
SMILESCCCNc1nccc(-c2ccc3cccnc3c2)n1
InChIInChI=1S/C16H16N4/c1-2-8-18-16-19-10-7-14(20-16)13-6-5-12-4-3-9-17-15(12)11-13/h3-7,9-11H,2,8H2,1H3,(H,18,19,20)
InChIKeyGFZTUKQOAXPWSH-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.51
Rot. Bonds4

About N-propyl-4-quinolin-7-ylpyrimidin-2-amine

N-propyl-4-quinolin-7-ylpyrimidin-2-amine (PubChem CID 81221832) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-propyl-4-quinolin-7-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN-propyl-4-quinolin-7-ylpyrimidin-2-amine
PubChem CID81221832
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC NameN-propyl-4-quinolin-7-ylpyrimidin-2-amine
SMILESCCCNc1nccc(-c2ccc3cccnc3c2)n1
InChIInChI=1S/C16H16N4/c1-2-8-18-16-19-10-7-14(20-16)13-6-5-12-4-3-9-17-15(12)11-13/h3-7,9-11H,2,8H2,1H3,(H,18,19,20)
InChIKeyGFZTUKQOAXPWSH-UHFFFAOYSA-N
XLogP3.51
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-chloro-4-fluorophenyl)-N-propylpyrimidin-2-amine
CID 113324799
4-(5-methyl-3-pyridinyl)-N-propylpyrimidin-2-amine
CID 115375546
N,4-dimethyl-6-quinolin-7-ylpyrimidin-2-amine
CID 81221352
N-[(2-quinolin-7-ylphenyl)methyl]propan-1-amine
CID 81230157
N-ethyl-4-(2-methylquinolin-6-yl)pyrimidin-2-amine
CID 81221340
4-[6-(1,2-oxazol-3-yl)-2-pyridinyl]-N-propylpyrimidin-2-amine
CID 170573663
7-(4-chloro-2-pyridinyl)quinoline
CID 102825160
7-(6-bromo-2-pyridinyl)quinoline
CID 81221969
2-methyl-N-propyl-1-quinolin-7-ylpropan-1-amine
CID 81220696
4-(7-methyl-1-benzofuran-2-yl)-N-propylpyrimidin-2-amine
CID 114734607
4-naphthalen-2-ylsulfanyl-N-propylpyrimidin-2-amine
CID 80873237
N-ethyl-5-quinolin-7-yl-1,3,4-thiadiazol-2-amine
CID 81222139

Frequently Asked Questions

What is the IUPAC name of N-propyl-4-quinolin-7-ylpyrimidin-2-amine?
The IUPAC name of N-propyl-4-quinolin-7-ylpyrimidin-2-amine (CID 81221832) is N-propyl-4-quinolin-7-ylpyrimidin-2-amine.
What is the SMILES notation for N-propyl-4-quinolin-7-ylpyrimidin-2-amine?
The canonical SMILES for N-propyl-4-quinolin-7-ylpyrimidin-2-amine is CCCNc1nccc(-c2ccc3cccnc3c2)n1.
What is the InChIKey of N-propyl-4-quinolin-7-ylpyrimidin-2-amine?
The InChIKey is GFZTUKQOAXPWSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-2-8-18-16-19-10-7-14(20-16)13-6-5-12-4-3-9-17-15(12)11-13/h3-7,9-11H,2,8H2,1H3,(H,18,19,20).
What are the key properties of N-propyl-4-quinolin-7-ylpyrimidin-2-amine?
N-propyl-4-quinolin-7-ylpyrimidin-2-amine has a molecular weight of 264.33 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-4-quinolin-7-ylpyrimidin-2-amine is sourced from PubChem (CID 81221832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).