1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine

C11H19N3 — CID 63200567

IUPAC1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine
SMILESCCCNC(C)Cc1ccnc(C)n1
InChIInChI=1S/C11H19N3/c1-4-6-12-9(2)8-11-5-7-13-10(3)14-11/h5,7,9,12H,4,6,8H2,1-3H3
InChIKeyHTEWKTDXWPXAMD-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.72
Rot. Bonds5

About 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine

1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine (PubChem CID 63200567) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine
PubChem CID63200567
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine
SMILESCCCNC(C)Cc1ccnc(C)n1
InChIInChI=1S/C11H19N3/c1-4-6-12-9(2)8-11-5-7-13-10(3)14-11/h5,7,9,12H,4,6,8H2,1-3H3
InChIKeyHTEWKTDXWPXAMD-UHFFFAOYSA-N
XLogP1.72
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(2-methylpyrimidin-4-yl)-1,2,4-oxadiazol-5-yl]-N-propylpropan-2-amine
CID 115531466
N-[(2-methylpyrimidin-4-yl)methyl]propan-1-amine
CID 46785088
2-(aminomethyl)-3-(2-methylpyrimidin-4-yl)-N-propylpropanamide
CID 115527337
4-(2-chloro-3-methylbutyl)-2-methylpyrimidine
CID 63203137
4-(2-bromobutyl)-2-methylpyrimidine
CID 63203331
N-propyl-1-pyridazin-3-ylpropan-2-amine
CID 63200569
1-cyclopropyl-N-ethyl-2-(2-methylpyrimidin-4-yl)ethanamine
CID 63355256
1-(6-ethylpyrimidin-4-yl)-N-propylpropan-2-amine
CID 63200666
N-ethyl-2-(2-methylpyrimidin-4-yl)ethanamine
CID 115529481
1-(3-methylpyrazin-2-yl)-N-[(2-methylpyrimidin-4-yl)methyl]ethanamine
CID 102612485
N-[1-(2-methylpyrimidin-4-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethyl]propan-1-amine
CID 115531098
2-methyl-4-(3-methylbutyl)pyrimidine
CID 143330492

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine?
The IUPAC name of 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine (CID 63200567) is 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine.
What is the SMILES notation for 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine?
The canonical SMILES for 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine is CCCNC(C)Cc1ccnc(C)n1.
What is the InChIKey of 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine?
The InChIKey is HTEWKTDXWPXAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-4-6-12-9(2)8-11-5-7-13-10(3)14-11/h5,7,9,12H,4,6,8H2,1-3H3.
What are the key properties of 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine?
1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine has a molecular weight of 193.29 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrimidin-4-yl)-N-propylpropan-2-amine is sourced from PubChem (CID 63200567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).