1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea

C17H15N3O — CID 23934831

IUPAC1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea
SMILESN#Cc1ccccc1NC(=O)NC1Cc2ccccc2C1
InChIInChI=1S/C17H15N3O/c18-11-14-7-3-4-8-16(14)20-17(21)19-15-9-12-5-1-2-6-13(12)10-15/h1-8,15H,9-10H2,(H2,19,20,21)
InChIKeyNUGKUYZIXKZRQZ-UHFFFAOYSA-N
MW277.33 g/mol
LogP2.85
Rot. Bonds2

About 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea

1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea (PubChem CID 23934831) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea.

Molecular Properties

Compound Name1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea
PubChem CID23934831
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea
SMILESN#Cc1ccccc1NC(=O)NC1Cc2ccccc2C1
InChIInChI=1S/C17H15N3O/c18-11-14-7-3-4-8-16(14)20-17(21)19-15-9-12-5-1-2-6-13(12)10-15/h1-8,15H,9-10H2,(H2,19,20,21)
InChIKeyNUGKUYZIXKZRQZ-UHFFFAOYSA-N
XLogP2.85
TPSA64.92 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyanophenyl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106737104
(2-cyanophenyl)urea
CID 13155570
1-(2-cyanophenyl)-3-(2-iodophenyl)urea
CID 108868891
1-(2,3-dihydro-1H-inden-2-yl)-3-(2,5-dimethylphenyl)urea
CID 23795651
2-[(2-cyanophenyl)carbamoylamino]benzoic acid
CID 61189461
3-(2-cyanophenyl)-1,1-diphenylurea
CID 3830875
2-cyano-N-(2,3-dihydro-1H-inden-2-yl)propanamide
CID 104694747
ethyl 2-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)benzoate
CID 3679782
1-N-(2-cyanophenyl)-2-N-cyclopropylcyclopropane-1,2-dicarboxamide
CID 109131004
N,N'-bis(2-cyanophenyl)-2,2-dimethylpropanediamide
CID 108970151
1-(2-cyanophenyl)-3-(2-phenylphenyl)urea
CID 102229386
N-(2-cyanophenyl)-3,4-dihydro-2H-chromene-3-carboxamide
CID 60675908

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea?
The IUPAC name of 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea (CID 23934831) is 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea.
What is the SMILES notation for 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea?
The canonical SMILES for 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea is N#Cc1ccccc1NC(=O)NC1Cc2ccccc2C1.
What is the InChIKey of 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea?
The InChIKey is NUGKUYZIXKZRQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c18-11-14-7-3-4-8-16(14)20-17(21)19-15-9-12-5-1-2-6-13(12)10-15/h1-8,15H,9-10H2,(H2,19,20,21).
What are the key properties of 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea?
1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea has a molecular weight of 277.33 g/mol, XLogP of 2.85, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyanophenyl)-3-(2,3-dihydro-1H-inden-2-yl)urea is sourced from PubChem (CID 23934831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).