4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide

C18H20N4O2 — CID 75507305

IUPAC4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide
SMILESCN(C)C(=O)c1cc(NC(=O)NC2Cc3ccccc3C2)ccn1
InChIInChI=1S/C18H20N4O2/c1-22(2)17(23)16-11-14(7-8-19-16)20-18(24)21-15-9-12-5-3-4-6-13(12)10-15/h3-8,11,15H,9-10H2,1-2H3,(H2,19,20,21,24)
InChIKeyUHNPNJWYJUTHSJ-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.07
Rot. Bonds3

About 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide

4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide (PubChem CID 75507305) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide
PubChem CID75507305
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC Name4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide
SMILESCN(C)C(=O)c1cc(NC(=O)NC2Cc3ccccc3C2)ccn1
InChIInChI=1S/C18H20N4O2/c1-22(2)17(23)16-11-14(7-8-19-16)20-18(24)21-15-9-12-5-3-4-6-13(12)10-15/h3-8,11,15H,9-10H2,1-2H3,(H2,19,20,21,24)
InChIKeyUHNPNJWYJUTHSJ-UHFFFAOYSA-N
XLogP2.07
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide?
The IUPAC name of 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide (CID 75507305) is 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide.
What is the SMILES notation for 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide?
The canonical SMILES for 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide is CN(C)C(=O)c1cc(NC(=O)NC2Cc3ccccc3C2)ccn1.
What is the InChIKey of 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide?
The InChIKey is UHNPNJWYJUTHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-22(2)17(23)16-11-14(7-8-19-16)20-18(24)21-15-9-12-5-3-4-6-13(12)10-15/h3-8,11,15H,9-10H2,1-2H3,(H2,19,20,21,24).
What are the key properties of 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide?
4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)-N,N-dimethylpyridine-2-carboxamide is sourced from PubChem (CID 75507305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).