N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide

C15H24N6O — CID 91843220

IUPACN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide
SMILESCCn1nc(C)c(NC(=O)CN(C)Cc2ncc(C)[nH]2)c1C
InChIInChI=1S/C15H24N6O/c1-6-21-12(4)15(11(3)19-21)18-14(22)9-20(5)8-13-16-7-10(2)17-13/h7H,6,8-9H2,1-5H3,(H,16,17)(H,18,22)
InChIKeyXSCNMLNEKUFJNP-UHFFFAOYSA-N
MW304.40 g/mol
LogP1.62
Rot. Bonds6

About N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide

N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide (PubChem CID 91843220) has the molecular formula C15H24N6O and a molecular weight of 304.40 g/mol. Its IUPAC name is N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide
PubChem CID91843220
Molecular FormulaC15H24N6O
Molecular Weight304.40 g/mol
Exact Mass304.20
IUPAC NameN-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide
SMILESCCn1nc(C)c(NC(=O)CN(C)Cc2ncc(C)[nH]2)c1C
InChIInChI=1S/C15H24N6O/c1-6-21-12(4)15(11(3)19-21)18-14(22)9-20(5)8-13-16-7-10(2)17-13/h7H,6,8-9H2,1-5H3,(H,16,17)(H,18,22)
InChIKeyXSCNMLNEKUFJNP-UHFFFAOYSA-N
XLogP1.62
TPSA78.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(5,6-dimethyl-1H-benzimidazol-2-yl)methyl-methylamino]-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide
CID 91835238
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2-amino-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide;hydrochloride
CID 130639181
2-[methyl-[(4-oxo-3H-quinazolin-2-yl)methyl]amino]-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 135783121
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CID 50974325
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CID 90652729
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CID 87014799
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CID 95125451
3-[(2S)-2-[ethyl(methyl)amino]butyl]-1-methyl-1-[(5-methyl-1H-imidazol-2-yl)methyl]urea
CID 125443963
2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide
CID 50984027
3-(1-ethyl-3,5-dimethylpyrazol-4-yl)-1-methyl-1-[(1S)-1-pyridin-3-ylpentyl]urea
CID 97436636
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Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide?
The IUPAC name of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide (CID 91843220) is N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide.
What is the SMILES notation for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide?
The canonical SMILES for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide is CCn1nc(C)c(NC(=O)CN(C)Cc2ncc(C)[nH]2)c1C.
What is the InChIKey of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide?
The InChIKey is XSCNMLNEKUFJNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N6O/c1-6-21-12(4)15(11(3)19-21)18-14(22)9-20(5)8-13-16-7-10(2)17-13/h7H,6,8-9H2,1-5H3,(H,16,17)(H,18,22).
What are the key properties of N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide?
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide has a molecular weight of 304.40 g/mol, XLogP of 1.62, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide is sourced from PubChem (CID 91843220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).