1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine

C15H22N4 — CID 106578976

IUPAC1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine
SMILESCCc1cccnc1Cn1cc(C)nc1NC(C)C
InChIInChI=1S/C15H22N4/c1-5-13-7-6-8-16-14(13)10-19-9-12(4)18-15(19)17-11(2)3/h6-9,11H,5,10H2,1-4H3,(H,17,18)
InChIKeyLFXUEEDYMDMXKY-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.02
Rot. Bonds5

About 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine

1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine (PubChem CID 106578976) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine.

Molecular Properties

Compound Name1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine
PubChem CID106578976
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine
SMILESCCc1cccnc1Cn1cc(C)nc1NC(C)C
InChIInChI=1S/C15H22N4/c1-5-13-7-6-8-16-14(13)10-19-9-12(4)18-15(19)17-11(2)3/h6-9,11H,5,10H2,1-4H3,(H,17,18)
InChIKeyLFXUEEDYMDMXKY-UHFFFAOYSA-N
XLogP3.02
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(3-ethyl-2-pyridinyl)methyl]-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106578970
4-methyl-1-(2-methylbutyl)-N-propan-2-ylimidazol-2-amine
CID 106570359
1-[(2-ethylphenyl)methyl]-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106574539
2,3-diethylpyridine
CID 14747123
4-methyl-N-propan-2-yl-1-(2-pyrrolidin-1-ylethyl)imidazol-2-amine
CID 106570264
1-ethyl-4-methyl-N-(1-pyridin-4-ylethyl)imidazol-2-amine
CID 106562046
1-ethyl-4-methyl-N-(2-methylpentan-3-yl)imidazol-2-amine
CID 106564923
[3-[(3-ethyl-2-pyridinyl)methyl]imidazol-4-yl]methanol
CID 82744844
1-(naphthalen-1-ylmethyl)-N-propan-2-ylimidazol-2-amine
CID 106571365
4-methyl-N-propan-2-yl-1-(3-propoxypropyl)imidazol-2-amine
CID 106578561
1-(3-methoxy-2-methylpropyl)-4-methyl-N-propan-2-ylimidazol-2-amine
CID 106566653
N-[(3-ethyl-2-pyridinyl)methyl]-6-methyl-2-propan-2-ylpyrimidin-4-amine
CID 82739374

Frequently Asked Questions

What is the IUPAC name of 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine?
The IUPAC name of 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine (CID 106578976) is 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine.
What is the SMILES notation for 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine?
The canonical SMILES for 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine is CCc1cccnc1Cn1cc(C)nc1NC(C)C.
What is the InChIKey of 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine?
The InChIKey is LFXUEEDYMDMXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-5-13-7-6-8-16-14(13)10-19-9-12(4)18-15(19)17-11(2)3/h6-9,11H,5,10H2,1-4H3,(H,17,18).
What are the key properties of 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine?
1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine has a molecular weight of 258.37 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-ethyl-2-pyridinyl)methyl]-4-methyl-N-propan-2-ylimidazol-2-amine is sourced from PubChem (CID 106578976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).