2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine

C11H19N3 — CID 116898245

IUPAC2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine
SMILESCCCc1ccnc(CC(C)CN)n1
InChIInChI=1S/C11H19N3/c1-3-4-10-5-6-13-11(14-10)7-9(2)8-12/h5-6,9H,3-4,7-8,12H2,1-2H3
InChIKeyNDTLOUXNCNOILH-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.57
Rot. Bonds5

About 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine

2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine (PubChem CID 116898245) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine
PubChem CID116898245
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine
SMILESCCCc1ccnc(CC(C)CN)n1
InChIInChI=1S/C11H19N3/c1-3-4-10-5-6-13-11(14-10)7-9(2)8-12/h5-6,9H,3-4,7-8,12H2,1-2H3
InChIKeyNDTLOUXNCNOILH-UHFFFAOYSA-N
XLogP1.57
TPSA51.80 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 ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-[4-(2-methylpropyl)pyrimidin-2-yl]propan-1-amine
CID 116898246
2-(3-methylhexyl)-4-propylpyrimidine
CID 142121373
azane;2,4-dipropylpyrimidine
CID 174500974
2-(2-propylpyrimidin-4-yl)ethanamine
CID 62744687
3-(4-tert-butylpyrimidin-2-yl)-2-methylpropan-1-amine
CID 116898247
4-butyl-2-propylpyrimidine
CID 20597890
2-propan-2-yl-4-propylpyrimidine
CID 58111235
1-(4-propylpyrimidin-2-yl)propan-2-one
CID 116901542
3-[4-(5-bromothiophen-2-yl)pyrimidin-2-yl]-2-methylpropan-1-amine
CID 116898266
2-methyl-3-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]propan-1-amine
CID 116898293
1-[2-(2-methylpropyl)pyrimidin-4-yl]butan-2-amine
CID 62744170
2-methyl-3-[4-(3-methylthiophen-2-yl)pyrimidin-2-yl]propan-1-amine
CID 116898304

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine?
The IUPAC name of 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine (CID 116898245) is 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine.
What is the SMILES notation for 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine?
The canonical SMILES for 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine is CCCc1ccnc(CC(C)CN)n1.
What is the InChIKey of 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine?
The InChIKey is NDTLOUXNCNOILH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-4-10-5-6-13-11(14-10)7-9(2)8-12/h5-6,9H,3-4,7-8,12H2,1-2H3.
What are the key properties of 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine?
2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine has a molecular weight of 193.29 g/mol, XLogP of 1.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(4-propylpyrimidin-2-yl)propan-1-amine is sourced from PubChem (CID 116898245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).