2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine

C14H21N5 — CID 80976153

IUPAC2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
SMILESCCCn1ccnc1Cc1nc(CC)nc(N)c1C
InChIInChI=1S/C14H21N5/c1-4-7-19-8-6-16-13(19)9-11-10(3)14(15)18-12(5-2)17-11/h6,8H,4-5,7,9H2,1-3H3,(H2,15,17,18)
InChIKeySNRVODHZYPSPOR-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.13
Rot. Bonds5

About 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine

2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine (PubChem CID 80976153) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
PubChem CID80976153
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
SMILESCCCn1ccnc1Cc1nc(CC)nc(N)c1C
InChIInChI=1S/C14H21N5/c1-4-7-19-8-6-16-13(19)9-11-10(3)14(15)18-12(5-2)17-11/h6,8H,4-5,7,9H2,1-3H3,(H2,15,17,18)
InChIKeySNRVODHZYPSPOR-UHFFFAOYSA-N
XLogP2.13
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-ethyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 79738670
3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine
CID 83170955
2-ethyl-5-methyl-6-(1,3-thiazol-2-ylmethyl)pyrimidin-4-amine
CID 80977439
3-fluoro-4-[(1-propylimidazol-2-yl)methyl]aniline
CID 79737831
4-[(1-propylimidazol-2-yl)methyl]-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 79734742
4-propan-2-yloxy-6-[(1-propylimidazol-2-yl)methyl]-1,3,5-triazin-2-amine
CID 79738576
tris(2-methyl-1-propylimidazole);trihydroiodide
CID 173173325
4-chloro-2-propyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidine
CID 80945789
N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 79738067
(1-propylimidazol-2-yl)methanesulfonyl chloride
CID 79761559
4-chloro-2-ethyl-6-(1-propylimidazol-2-yl)pyrimidine
CID 80936041
1-(3,5-dimethylphenyl)-2-(1-propylimidazol-2-yl)ethanamine
CID 105012197

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine (CID 80976153) is 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine is CCCn1ccnc1Cc1nc(CC)nc(N)c1C.
What is the InChIKey of 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is SNRVODHZYPSPOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-4-7-19-8-6-16-13(19)9-11-10(3)14(15)18-12(5-2)17-11/h6,8H,4-5,7,9H2,1-3H3,(H2,15,17,18).
What are the key properties of 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine?
2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 259.36 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 80976153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).