N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide

C16H18N4O — CID 71913209

IUPACN-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide
SMILESCc1cnc(NC(=O)CCc2cn(C)c3ccccc23)[nH]1
InChIInChI=1S/C16H18N4O/c1-11-9-17-16(18-11)19-15(21)8-7-12-10-20(2)14-6-4-3-5-13(12)14/h3-6,9-10H,7-8H2,1-2H3,(H2,17,18,19,21)
InChIKeyUDGJOPSJMJSZOH-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.78
Rot. Bonds4

About N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide

N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide (PubChem CID 71913209) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide.

Molecular Properties

Compound NameN-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide
PubChem CID71913209
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC NameN-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide
SMILESCc1cnc(NC(=O)CCc2cn(C)c3ccccc23)[nH]1
InChIInChI=1S/C16H18N4O/c1-11-9-17-16(18-11)19-15(21)8-7-12-10-20(2)14-6-4-3-5-13(12)14/h3-6,9-10H,7-8H2,1-2H3,(H2,17,18,19,21)
InChIKeyUDGJOPSJMJSZOH-UHFFFAOYSA-N
XLogP2.78
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 71917336
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CID 167074114
3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide
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3-(1-methylindol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
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5-(1-methylindol-3-yl)-N-(1,3-thiazol-2-yl)pentanamide
CID 140983112
2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide
CID 82495529
N-[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-3-(1-methylindol-3-yl)propanamide
CID 71709200
N-(2-bromophenyl)-4-(1-methylindol-3-yl)butanamide
CID 22522913
cis-(1R,3S)-3-[3-(1-methylindol-3-yl)propanoylamino]cyclopentane-1-carboxylic acid
CID 120678962
4-(1-methylindol-3-yl)butanamide
CID 175206986
3-(1-methylindol-3-yl)-N-(1-pyridin-2-ylazetidin-3-yl)propanamide
CID 154847663
N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide?
The IUPAC name of N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide (CID 71913209) is N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide.
What is the SMILES notation for N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide?
The canonical SMILES for N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide is Cc1cnc(NC(=O)CCc2cn(C)c3ccccc23)[nH]1.
What is the InChIKey of N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide?
The InChIKey is UDGJOPSJMJSZOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-11-9-17-16(18-11)19-15(21)8-7-12-10-20(2)14-6-4-3-5-13(12)14/h3-6,9-10H,7-8H2,1-2H3,(H2,17,18,19,21).
What are the key properties of N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide?
N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide has a molecular weight of 282.35 g/mol, XLogP of 2.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide is sourced from PubChem (CID 71913209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).