N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide

C15H22N4O2 — CID 122562082

IUPACN-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide
SMILESCC(C)c1cc(C(=O)NC(c2nccn2C)C(C)C)on1
InChIInChI=1S/C15H22N4O2/c1-9(2)11-8-12(21-18-11)15(20)17-13(10(3)4)14-16-6-7-19(14)5/h6-10,13H,1-5H3,(H,17,20)
InChIKeyIQSSYYMPZNXXNQ-UHFFFAOYSA-N
MW290.37 g/mol
LogP2.66
Rot. Bonds5

About N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide

N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide (PubChem CID 122562082) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide
PubChem CID122562082
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide
SMILESCC(C)c1cc(C(=O)NC(c2nccn2C)C(C)C)on1
InChIInChI=1S/C15H22N4O2/c1-9(2)11-8-12(21-18-11)15(20)17-13(10(3)4)14-16-6-7-19(14)5/h6-10,13H,1-5H3,(H,17,20)
InChIKeyIQSSYYMPZNXXNQ-UHFFFAOYSA-N
XLogP2.66
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1R)-2-methyl-1-(1-methylimidazol-2-yl)propyl]-1H-pyrazole-4-carboxamide
CID 125441329
4-chloro-1-methyl-N-[(1R)-2-methyl-1-(1-methylimidazol-2-yl)propyl]pyrrole-2-carboxamide
CID 125437179
N-[(1S)-2-methyl-1-(1-methylimidazol-2-yl)propyl]-1,3-thiazole-4-carboxamide
CID 125446155
N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]prop-2-enamide
CID 166406040
2-(2-methoxyethoxy)-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
CID 118787632
3-hydroxy-N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]azetidine-1-carboxamide
CID 122560977
3-hydroxy-N-[(1R)-2-methyl-1-(1-methylimidazol-2-yl)propyl]azetidine-1-carboxamide
CID 125439120
N-[2-[[(1R)-2-methyl-1-(1-methylimidazol-2-yl)propyl]carbamoylamino]ethyl]acetamide
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N-[(1R)-2-methyl-1-(1-methylimidazol-2-yl)propyl]-1-benzoxepine-4-carboxamide
CID 125442659
1-methyl-3-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-1-[(3-methyloxetan-3-yl)methyl]urea
CID 122571679
2-(3-methoxyphenyl)-N-[(1R)-2-methyl-1-(1-methylimidazol-2-yl)propyl]acetamide
CID 125164841
(2S)-4-methyl-2-[(3-propan-2-yl-1,2-oxazole-5-carbonyl)amino]pentanoic acid
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Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide (CID 122562082) is N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide is CC(C)c1cc(C(=O)NC(c2nccn2C)C(C)C)on1.
What is the InChIKey of N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide?
The InChIKey is IQSSYYMPZNXXNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-9(2)11-8-12(21-18-11)15(20)17-13(10(3)4)14-16-6-7-19(14)5/h6-10,13H,1-5H3,(H,17,20).
What are the key properties of N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide?
N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-1-(1-methylimidazol-2-yl)propyl]-3-propan-2-yl-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 122562082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).