N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine

C15H25N5 — CID 65171777

IUPACN-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
SMILESCCn1cc(Cn2c(CNCC(C)C)cnc2C)cn1
InChIInChI=1S/C15H25N5/c1-5-19-10-14(7-18-19)11-20-13(4)17-9-15(20)8-16-6-12(2)3/h7,9-10,12,16H,5-6,8,11H2,1-4H3
InChIKeyJKTJVBSISWOVJX-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.20
Rot. Bonds7

About N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine

N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine (PubChem CID 65171777) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
PubChem CID65171777
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
SMILESCCn1cc(Cn2c(CNCC(C)C)cnc2C)cn1
InChIInChI=1S/C15H25N5/c1-5-19-10-14(7-18-19)11-20-13(4)17-9-15(20)8-16-6-12(2)3/h7,9-10,12,16H,5-6,8,11H2,1-4H3
InChIKeyJKTJVBSISWOVJX-UHFFFAOYSA-N
XLogP2.20
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine with MolForge

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Related Compounds

1-[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]-N-methylmethanamine
CID 65172508
N-[[3-[(4-fluorophenyl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
CID 65172235
N-[[4-[(1-ethylpyrazol-4-yl)methoxy]phenyl]methyl]-2-methylpropan-1-amine
CID 63063064
3-(1-ethylpyrazol-4-yl)-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 62528296
methyl 3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazole-4-carboxylate
CID 65171502
N-[[3-[(4-fluoro-2-methylphenyl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
CID 114349347
2-cyclopropyl-N-[(1-ethylpyrazol-4-yl)methyl]propan-1-amine
CID 115622207
N-[[1-[(1-ethylpyrazol-4-yl)methyl]piperidin-4-yl]methyl]-2-methylpropan-1-amine
CID 62592588
N-[[3-(4-methoxybutyl)-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine
CID 104649983
2-methyl-N-[[2-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]imidazol-4-yl]methyl]propan-1-amine
CID 112591974
N-[(1-ethylpyrazol-4-yl)methyl]-2,3,3-trimethylbutan-1-amine
CID 78966858
2-methyl-N-[[2-methyl-3-[2-(trifluoromethylsulfanyl)ethyl]imidazol-4-yl]methyl]propan-1-amine
CID 116627167

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine (CID 65171777) is N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine is CCn1cc(Cn2c(CNCC(C)C)cnc2C)cn1.
What is the InChIKey of N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine?
The InChIKey is JKTJVBSISWOVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-5-19-10-14(7-18-19)11-20-13(4)17-9-15(20)8-16-6-12(2)3/h7,9-10,12,16H,5-6,8,11H2,1-4H3.
What are the key properties of N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine?
N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine has a molecular weight of 275.40 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(1-ethylpyrazol-4-yl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 65171777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).