N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide

C17H21N3O — CID 91782036

IUPACN-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide
SMILESCc1nccn1CCC(=O)N(C)C1Cc2ccccc2C1
InChIInChI=1S/C17H21N3O/c1-13-18-8-10-20(13)9-7-17(21)19(2)16-11-14-5-3-4-6-15(14)12-16/h3-6,8,10,16H,7,9,11-12H2,1-2H3
InChIKeyCHHNYBBQLZJZOL-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.21
Rot. Bonds4

About N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide

N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide (PubChem CID 91782036) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide
PubChem CID91782036
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC NameN-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide
SMILESCc1nccn1CCC(=O)N(C)C1Cc2ccccc2C1
InChIInChI=1S/C17H21N3O/c1-13-18-8-10-20(13)9-7-17(21)19(2)16-11-14-5-3-4-6-15(14)12-16/h3-6,8,10,16H,7,9,11-12H2,1-2H3
InChIKeyCHHNYBBQLZJZOL-UHFFFAOYSA-N
XLogP2.21
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(2-methylimidazol-1-yl)butan-2-one
CID 43121484
N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-4-(methylamino)butanamide
CID 119746184
(2R,3R)-N-(2,3-dihydro-1H-inden-2-yl)-2-(1-ethylimidazol-2-yl)-N-methyloxolane-3-carboxamide
CID 128986828
1-[2-(2-methylimidazol-1-yl)ethyl]-3,4-dihydro-2H-quinoline-3-carboxylic acid
CID 106903029
3-(2-ethylimidazol-1-yl)-N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]propanamide
CID 124939708
2-[methyl-[2-(2-methylimidazol-1-yl)ethyl]amino]acetic acid
CID 61493400
N-[(2,2-diphenylcyclopropyl)methyl]-N-methyl-2-(2-methylimidazol-1-yl)ethanamine
CID 74241273
1,3-dimethyl-N-[3-(2-methylimidazol-1-yl)propyl]-3,5-dihydro-2H-1,4-benzodiazepine-4-carboxamide
CID 75377529
3-(2-methylimidazol-1-yl)-1-(4-methyl-3-phenylpiperazin-1-yl)propan-1-one
CID 86284577
N-(3-aminopropyl)-N-methyl-3-(2-phenylimidazol-1-yl)propanamide
CID 61070466
3-amino-N-(2,3-dihydro-1H-inden-2-yl)-N-methylbutanamide;hydrochloride
CID 119746207
3-(2-methylimidazol-1-yl)-N-[5-oxo-1-(2-phenylethyl)pyrrolidin-3-yl]propanamide
CID 45225213

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide (CID 91782036) is N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide is Cc1nccn1CCC(=O)N(C)C1Cc2ccccc2C1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide?
The InChIKey is CHHNYBBQLZJZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-13-18-8-10-20(13)9-7-17(21)19(2)16-11-14-5-3-4-6-15(14)12-16/h3-6,8,10,16H,7,9,11-12H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide?
N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide has a molecular weight of 283.38 g/mol, XLogP of 2.21, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-(2-methylimidazol-1-yl)propanamide is sourced from PubChem (CID 91782036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).