2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine

C13H23N3 — CID 62744926

IUPAC2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine
SMILESCCCc1nc(C)c(CCNCC)c(C)n1
InChIInChI=1S/C13H23N3/c1-5-7-13-15-10(3)12(11(4)16-13)8-9-14-6-2/h14H,5-9H2,1-4H3
InChIKeyAZOUPEYQBQSNOC-UHFFFAOYSA-N
MW221.35 g/mol
LogP2.20
Rot. Bonds6

About 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine

2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine (PubChem CID 62744926) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine.

Molecular Properties

Compound Name2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine
PubChem CID62744926
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine
SMILESCCCc1nc(C)c(CCNCC)c(C)n1
InChIInChI=1S/C13H23N3/c1-5-7-13-15-10(3)12(11(4)16-13)8-9-14-6-2/h14H,5-9H2,1-4H3
InChIKeyAZOUPEYQBQSNOC-UHFFFAOYSA-N
XLogP2.20
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-butyl-4,6-dimethylpyrimidin-5-yl)-N-ethylethanamine
CID 79412272
N-[2-(4,6-dimethyl-2-propylpyrimidin-5-yl)ethyl]propan-1-amine
CID 62745813
3-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-methylpropan-1-amine
CID 62745255
N-[2-(4,6-dimethyl-2-propylpyrimidin-5-yl)ethyl]cyclopropanamine
CID 62744769
N-[2-[2-[2-(dimethylamino)ethyl]-4,6-dimethylpyrimidin-5-yl]ethyl]propan-1-amine
CID 115347172
3-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-propan-2-ylpropan-1-amine
CID 62744572
3-[4,6-dimethyl-2-(3,3,3-trifluoropropyl)pyrimidin-5-yl]-N-ethylpropan-1-amine
CID 79965289
3-(4,6-dimethyl-2-propylpyrimidin-5-yl)propan-1-amine
CID 62745596
N-[2-[2-[2-(2-methoxyethoxy)ethyl]-4,6-dimethylpyrimidin-5-yl]ethyl]propan-1-amine
CID 102929117
N-ethyl-3-[2-[2-(2-methoxyethoxy)ethyl]-4,6-dimethylpyrimidin-5-yl]propan-1-amine
CID 102929114
N,N-diethyl-5-[3-(ethylamino)propyl]-4,6-dimethylpyrimidin-2-amine
CID 55113584
2-[4,6-dimethyl-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]-N-ethylethanamine
CID 62745632

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine?
The IUPAC name of 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine (CID 62744926) is 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine.
What is the SMILES notation for 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine?
The canonical SMILES for 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine is CCCc1nc(C)c(CCNCC)c(C)n1.
What is the InChIKey of 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine?
The InChIKey is AZOUPEYQBQSNOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-5-7-13-15-10(3)12(11(4)16-13)8-9-14-6-2/h14H,5-9H2,1-4H3.
What are the key properties of 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine?
2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine has a molecular weight of 221.35 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dimethyl-2-propylpyrimidin-5-yl)-N-ethylethanamine is sourced from PubChem (CID 62744926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).