N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine

C13H19N3 — CID 63319052

IUPACN-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine
SMILESCCNCc1nc(C2CC2)cc(C2CC2)n1
InChIInChI=1S/C13H19N3/c1-2-14-8-13-15-11(9-3-4-9)7-12(16-13)10-5-6-10/h7,9-10,14H,2-6,8H2,1H3
InChIKeySFMLQVHLXULIOO-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.34
Rot. Bonds5

About N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine

N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine (PubChem CID 63319052) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine
PubChem CID63319052
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC NameN-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine
SMILESCCNCc1nc(C2CC2)cc(C2CC2)n1
InChIInChI=1S/C13H19N3/c1-2-14-8-13-15-11(9-3-4-9)7-12(16-13)10-5-6-10/h7,9-10,14H,2-6,8H2,1H3
InChIKeySFMLQVHLXULIOO-UHFFFAOYSA-N
XLogP2.34
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-cyclopropyl-6-propylpyrimidin-2-yl)methyl]ethanamine
CID 63319051
N-[(4-cyclobutyl-6-methylpyrimidin-2-yl)methyl]ethanamine
CID 116893201
N-[(2-cyclopropyl-1,3-thiazol-4-yl)methyl]ethanamine
CID 61281051
N-[(5-cyclopropyl-2-pyridinyl)methyl]ethanamine
CID 163383215
N-[[6-(ethylaminomethyl)-1,2,4,5-tetrazin-3-yl]methyl]ethanamine
CID 71476444
[6-cyclopropyl-2-(propylsulfanylmethyl)pyrimidin-4-yl]hydrazine
CID 65129298
N-[[2-(4-cyclopropylphenyl)-1,3-thiazol-4-yl]methyl]ethanamine
CID 79980351
6-cyclopropyl-N,4-diethylpyridine-2-carboxamide
CID 169246826
N-[[4-cyclopropyl-2-(5-fluoro-2-pyridinyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 114367130
N-[(5-cyclopropyl-1-ethylpyrazol-4-yl)methyl]ethanamine
CID 66440322
N-[(5-cyclohexyl-1,2,4-oxadiazol-3-yl)methyl]ethanamine
CID 62342162
6-cyclopropyl-2-[(dimethylamino)methyl]-N-propylpyrimidin-4-amine
CID 79088810

Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine?
The IUPAC name of N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine (CID 63319052) is N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine?
The canonical SMILES for N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine is CCNCc1nc(C2CC2)cc(C2CC2)n1.
What is the InChIKey of N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine?
The InChIKey is SFMLQVHLXULIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-2-14-8-13-15-11(9-3-4-9)7-12(16-13)10-5-6-10/h7,9-10,14H,2-6,8H2,1H3.
What are the key properties of N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine?
N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine has a molecular weight of 217.32 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,6-dicyclopropylpyrimidin-2-yl)methyl]ethanamine is sourced from PubChem (CID 63319052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).