3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine

C13H18N4 — CID 83170955

IUPAC3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine
SMILESCCCn1ccnc1Cc1cnc(N)c(C)c1
InChIInChI=1S/C13H18N4/c1-3-5-17-6-4-15-12(17)8-11-7-10(2)13(14)16-9-11/h4,6-7,9H,3,5,8H2,1-2H3,(H2,14,16)
InChIKeyKTGZHSIGZYCQIK-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.17
Rot. Bonds4

About 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine

3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine (PubChem CID 83170955) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine
PubChem CID83170955
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine
SMILESCCCn1ccnc1Cc1cnc(N)c(C)c1
InChIInChI=1S/C13H18N4/c1-3-5-17-6-4-15-12(17)8-11-7-10(2)13(14)16-9-11/h4,6-7,9H,3,5,8H2,1-2H3,(H2,14,16)
InChIKeyKTGZHSIGZYCQIK-UHFFFAOYSA-N
XLogP2.17
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(1-ethylimidazol-2-yl)methyl]-5-methylpyridin-2-amine
CID 79761192
5-ethyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 79738670
2-ethyl-5-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 80976153
4-[(1-butylimidazol-2-yl)methyl]aniline
CID 70226116
[2-fluoro-4-[(1-propylimidazol-2-yl)methyl]phenyl]methanamine
CID 79737643
3-fluoro-4-[(1-propylimidazol-2-yl)methyl]aniline
CID 79737831
N-[[3-methyl-4-[(1-propylimidazol-2-yl)methyl]phenyl]methyl]cyclopropanamine
CID 79739257
tris(2-methyl-1-propylimidazole);trihydroiodide
CID 173173325
3-chloro-5-[(1-propylimidazol-2-yl)methyl]benzoic acid
CID 114020606
3-methyl-5-(1-methylimidazol-2-yl)pyridin-2-amine
CID 83171112
N-ethyl-2-methyl-6-[(1-propylimidazol-2-yl)methyl]pyrimidin-4-amine
CID 79738067
N-methyl-1-[3-[(1-propylimidazol-2-yl)methyl]phenyl]propan-1-amine
CID 79738919

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine (CID 83170955) is 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine is CCCn1ccnc1Cc1cnc(N)c(C)c1.
What is the InChIKey of 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine?
The InChIKey is KTGZHSIGZYCQIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-3-5-17-6-4-15-12(17)8-11-7-10(2)13(14)16-9-11/h4,6-7,9H,3,5,8H2,1-2H3,(H2,14,16).
What are the key properties of 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine?
3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine has a molecular weight of 230.31 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-[(1-propylimidazol-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 83170955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).