2-butyl-6-ethyl-N-propylpyrimidin-4-amine

C13H23N3 — CID 79413331

IUPAC2-butyl-6-ethyl-N-propylpyrimidin-4-amine
SMILESCCCCc1nc(CC)cc(NCCC)n1
InChIInChI=1S/C13H23N3/c1-4-7-8-12-15-11(6-3)10-13(16-12)14-9-5-2/h10H,4-9H2,1-3H3,(H,14,15,16)
InChIKeyIFCMZBRSRCQGPU-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.20
Rot. Bonds7

About 2-butyl-6-ethyl-N-propylpyrimidin-4-amine

2-butyl-6-ethyl-N-propylpyrimidin-4-amine (PubChem CID 79413331) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2-butyl-6-ethyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-butyl-6-ethyl-N-propylpyrimidin-4-amine
PubChem CID79413331
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2-butyl-6-ethyl-N-propylpyrimidin-4-amine
SMILESCCCCc1nc(CC)cc(NCCC)n1
InChIInChI=1S/C13H23N3/c1-4-7-8-12-15-11(6-3)10-13(16-12)14-9-5-2/h10H,4-9H2,1-3H3,(H,14,15,16)
InChIKeyIFCMZBRSRCQGPU-UHFFFAOYSA-N
XLogP3.20
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-butyl-6-ethylpyrimidin-4-yl)hydrazine
CID 79413062
4-N-butyl-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80946225
6-ethyl-2-(methylsulfonylmethyl)-N-propylpyrimidin-4-amine
CID 62474013
2-butyl-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 79412373
2-[(3,5-dimethylphenyl)methyl]-6-ethyl-N-propylpyrimidin-4-amine
CID 63484694
2-[2-(dimethylamino)ethyl]-N,6-dipropylpyrimidin-4-amine
CID 115346995
6-N-methyl-4-N,2-dipropylpyrimidine-4,6-diamine
CID 80946214
6-methyl-N,2-dipropylpyrimidin-4-amine
CID 6460821
2-(2-ethoxyethyl)-6-(2-methylpropyl)-N-propylpyrimidin-4-amine
CID 106815334
2-ethyl-4-N-(4-methylpentyl)-6-N-propylpyrimidine-4,6-diamine
CID 80935431
4-[(tert-butylamino)methyl]-6-ethyl-N-propylpyridin-2-amine
CID 113381462
2-heptyl-6-methyl-N-octylpyrimidin-4-amine
CID 58693161

Frequently Asked Questions

What is the IUPAC name of 2-butyl-6-ethyl-N-propylpyrimidin-4-amine?
The IUPAC name of 2-butyl-6-ethyl-N-propylpyrimidin-4-amine (CID 79413331) is 2-butyl-6-ethyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-butyl-6-ethyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-butyl-6-ethyl-N-propylpyrimidin-4-amine is CCCCc1nc(CC)cc(NCCC)n1.
What is the InChIKey of 2-butyl-6-ethyl-N-propylpyrimidin-4-amine?
The InChIKey is IFCMZBRSRCQGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-4-7-8-12-15-11(6-3)10-13(16-12)14-9-5-2/h10H,4-9H2,1-3H3,(H,14,15,16).
What are the key properties of 2-butyl-6-ethyl-N-propylpyrimidin-4-amine?
2-butyl-6-ethyl-N-propylpyrimidin-4-amine has a molecular weight of 221.35 g/mol, XLogP of 3.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-6-ethyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 79413331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).