N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide

C9H15N3O — CID 131134121

IUPACN,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide
SMILESCC(C)C(=O)N(C)c1nccn1C
InChIInChI=1S/C9H15N3O/c1-7(2)8(13)12(4)9-10-5-6-11(9)3/h5-7H,1-4H3
InChIKeyPGHPWYKCIQESKU-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.04
Rot. Bonds2

About N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide

N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide (PubChem CID 131134121) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide
PubChem CID131134121
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC NameN,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide
SMILESCC(C)C(=O)N(C)c1nccn1C
InChIInChI=1S/C9H15N3O/c1-7(2)8(13)12(4)9-10-5-6-11(9)3/h5-7H,1-4H3
InChIKeyPGHPWYKCIQESKU-UHFFFAOYSA-N
XLogP1.04
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-[(1-methylimidazol-2-yl)amino]propanamide
CID 62133303
(2R)-N,N-dimethyl-2-[1-(1-methylimidazol-2-yl)ethylamino]propanamide
CID 103914492
2-[butan-2-yl-(1-methylimidazol-2-yl)amino]acetic acid
CID 62131479
3-[ethyl-(1-methylimidazol-2-yl)amino]butanoic acid
CID 62827444
2-bromo-N-methyl-N-[(1-methylimidazol-2-yl)methyl]propanamide
CID 107904600
N,N,4-trimethyl-2-[(1-methylimidazol-2-yl)methylamino]pentanamide
CID 62357240
1-[1-(dimethylamino)-1-oxopropan-2-yl]-5-(1-methylimidazol-2-yl)triazole-4-carboxylic acid
CID 103116546
3-amino-1-(1-methylimidazol-2-yl)butan-2-one
CID 116551768
methyl 2-methyl-3-[methyl-(4-methyl-3-oxopyrazin-2-yl)amino]propanoate
CID 62940103
N-methyl-N-(1-methylimidazol-2-yl)-4-phenylmethoxybenzamide
CID 154801364
2-(dimethylamino)-1-(1-methylimidazol-2-yl)ethanone
CID 79078425
1,1-dimethyl-3-(1-methylimidazol-2-yl)urea
CID 110470347

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide?
The IUPAC name of N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide (CID 131134121) is N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide.
What is the SMILES notation for N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide?
The canonical SMILES for N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide is CC(C)C(=O)N(C)c1nccn1C.
What is the InChIKey of N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide?
The InChIKey is PGHPWYKCIQESKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-7(2)8(13)12(4)9-10-5-6-11(9)3/h5-7H,1-4H3.
What are the key properties of N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide?
N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide has a molecular weight of 181.24 g/mol, XLogP of 1.04, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(1-methylimidazol-2-yl)propanamide is sourced from PubChem (CID 131134121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).