2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid

C15H18N2O3 — CID 61185132

IUPAC2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)Nc1ccc2c(c1)CCC2)C1CC1
InChIInChI=1S/C15H18N2O3/c18-14(19)9-17(13-6-7-13)15(20)16-12-5-4-10-2-1-3-11(10)8-12/h4-5,8,13H,1-3,6-7,9H2,(H,16,20)(H,18,19)
InChIKeyYICWELCFDCCVSO-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.26
Rot. Bonds4

About 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid

2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid (PubChem CID 61185132) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid
PubChem CID61185132
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)Nc1ccc2c(c1)CCC2)C1CC1
InChIInChI=1S/C15H18N2O3/c18-14(19)9-17(13-6-7-13)15(20)16-12-5-4-10-2-1-3-11(10)8-12/h4-5,8,13H,1-3,6-7,9H2,(H,16,20)(H,18,19)
InChIKeyYICWELCFDCCVSO-UHFFFAOYSA-N
XLogP2.26
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-bromophenyl)carbamoyl-cyclopropylamino]acetic acid
CID 54978714
2-[(4-acetylphenyl)carbamoyl-cyclopropylamino]acetic acid
CID 61341696
2-[(3-bromo-4-methylphenyl)carbamoyl-cyclopentylamino]acetic acid
CID 63334919
2-[cyclopropyl-[(4-propan-2-ylphenyl)carbamoyl]amino]acetic acid
CID 61185121
1-cyclopropyl-1-(2-hydroxyethyl)-3-(8-oxo-6,7-dihydro-5H-naphthalen-2-yl)urea
CID 111840828
1-(2-cyclopropyl-2-hydroxyethyl)-3-(2,3-dihydro-1H-inden-5-yl)-1-methylurea
CID 111859076
2-[2,3-dihydro-1H-inden-5-ylcarbamoyl(methyl)amino]propanoic acid
CID 62638284
2-[2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethoxy]acetic acid
CID 650247
(2S)-1-(2,3-dihydro-1H-inden-5-ylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 61185659
N-(2,3-dihydro-1H-inden-5-yl)-2-sulfanylacetamide
CID 60650065
1-(2,3-dihydro-1H-inden-5-ylcarbamoyl)cyclobutane-1-carboxylic acid
CID 62095213
N-(2,3-dihydro-1H-inden-5-yl)-2-[[(1R)-2,3-dihydro-1H-inden-1-yl]-methylamino]acetamide
CID 36676150

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid?
The IUPAC name of 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid (CID 61185132) is 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid is O=C(O)CN(C(=O)Nc1ccc2c(c1)CCC2)C1CC1.
What is the InChIKey of 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid?
The InChIKey is YICWELCFDCCVSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c18-14(19)9-17(13-6-7-13)15(20)16-12-5-4-10-2-1-3-11(10)8-12/h4-5,8,13H,1-3,6-7,9H2,(H,16,20)(H,18,19).
What are the key properties of 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid?
2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid has a molecular weight of 274.32 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(2,3-dihydro-1H-inden-5-ylcarbamoyl)amino]acetic acid is sourced from PubChem (CID 61185132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).