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

C14H21N5 — CID 79738067

IUPACN-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
SMILESCCCn1ccnc1Cc1cc(NCC)nc(C)n1
InChIInChI=1S/C14H21N5/c1-4-7-19-8-6-16-14(19)10-12-9-13(15-5-2)18-11(3)17-12/h6,8-9H,4-5,7,10H2,1-3H3,(H,15,17,18)
InChIKeyNZOYFSNMRIEXLO-UHFFFAOYSA-N
MW259.36 g/mol
LogP2.41
Rot. Bonds6

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

N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine (PubChem CID 79738067) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
PubChem CID79738067
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC NameN-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
SMILESCCCn1ccnc1Cc1cc(NCC)nc(C)n1
InChIInChI=1S/C14H21N5/c1-4-7-19-8-6-16-14(19)10-12-9-13(15-5-2)18-11(3)17-12/h6,8-9H,4-5,7,10H2,1-3H3,(H,15,17,18)
InChIKeyNZOYFSNMRIEXLO-UHFFFAOYSA-N
XLogP2.41
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[(1-ethylimidazol-2-yl)methyl]-N,2-dimethylpyrimidin-4-amine
CID 79737865
4-chloro-6-[(1-ethylimidazol-2-yl)methyl]-2-methylpyrimidine
CID 79738348
N-methyl-2-propan-2-yl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 80952651
N-methyl-6-[(1-propylimidazol-2-yl)methyl]-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769668
4-chloro-2-propyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidine
CID 80945789
N,6-diethyl-2-methylpyrimidin-4-amine
CID 62191281
N-ethyl-6-(2-ethylimidazol-1-yl)-2-methylpyrimidin-4-amine
CID 80857445
4-ethoxy-N-ethyl-6-[(1-propylimidazol-2-yl)methyl]-1,3,5-triazin-2-amine
CID 79733828
2-chloro-4-[(1-ethylimidazol-2-yl)methyl]-6-methylpyrimidine
CID 79739014
3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine
CID 83170955
tris(2-methyl-1-propylimidazole);trihydroiodide
CID 173173325
3-methyl-N-[(1-propylimidazol-2-yl)methyl]pentan-3-amine
CID 106328036

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine?
The IUPAC name of N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine (CID 79738067) is N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine is CCCn1ccnc1Cc1cc(NCC)nc(C)n1.
What is the InChIKey of N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine?
The InChIKey is NZOYFSNMRIEXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-4-7-19-8-6-16-14(19)10-12-9-13(15-5-2)18-11(3)17-12/h6,8-9H,4-5,7,10H2,1-3H3,(H,15,17,18).
What are the key properties of N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine?
N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine has a molecular weight of 259.36 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 79738067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).