N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide

C20H23N3O — CID 11110049

IUPACN-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide
SMILESCN(C)CCNC(=O)C1=C(Cc2ccncc2)c2ccccc2C1
InChIInChI=1S/C20H23N3O/c1-23(2)12-11-22-20(24)19-14-16-5-3-4-6-17(16)18(19)13-15-7-9-21-10-8-15/h3-10H,11-14H2,1-2H3,(H,22,24)
InChIKeyOATWUYJMZFPPQE-UHFFFAOYSA-N
MW321.42 g/mol
LogP2.31
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide

N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide (PubChem CID 11110049) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide
PubChem CID11110049
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC NameN-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide
SMILESCN(C)CCNC(=O)C1=C(Cc2ccncc2)c2ccccc2C1
InChIInChI=1S/C20H23N3O/c1-23(2)12-11-22-20(24)19-14-16-5-3-4-6-17(16)18(19)13-15-7-9-21-10-8-15/h3-10H,11-14H2,1-2H3,(H,22,24)
InChIKeyOATWUYJMZFPPQE-UHFFFAOYSA-N
XLogP2.31
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide 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

N-[2-(dimethylamino)ethyl]-3-phenylpyridine-4-carboxamide
CID 91804668
N-[2-(dimethylamino)ethyl]-4,5-dihydro-2H-benzo[g]indazole-3-carboxamide
CID 20953939
N-[2-(dimethylamino)ethyl]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide
CID 53032327
1-[2-(dimethylamino)ethyl]-3-(9H-fluoren-2-yl)-1-(pyridin-3-ylmethyl)urea
CID 87009139
N-[2-(dimethylamino)ethyl]-6-[methyl(2-pyridin-4-ylethyl)amino]pyridazine-3-carboxamide
CID 109115358
1-(3-chloro-1H-inden-2-yl)-3-(dimethylamino)propan-1-one
CID 170859460
N-[2-(dimethylamino)ethyl]-6-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboxamide
CID 109153874
N-[3-(dimethylamino)propyl]pyridine-4-carboxamide;hydrochloride
CID 110755338
N-[2-(dimethylamino)ethyl]-2-(2-pyridin-4-yl-1,3-thiazol-4-yl)acetamide
CID 39084396
3-amino-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 110849614
2-[2-(dimethylamino)ethylcarbamoyl]-6-phenylbenzoic acid
CID 123504584
5-N-[2-(dimethylamino)ethyl]-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109104046

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide (CID 11110049) is N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide is CN(C)CCNC(=O)C1=C(Cc2ccncc2)c2ccccc2C1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide?
The InChIKey is OATWUYJMZFPPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c1-23(2)12-11-22-20(24)19-14-16-5-3-4-6-17(16)18(19)13-15-7-9-21-10-8-15/h3-10H,11-14H2,1-2H3,(H,22,24).
What are the key properties of N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide?
N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide has a molecular weight of 321.42 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-(pyridin-4-ylmethyl)-1H-indene-2-carboxamide is sourced from PubChem (CID 11110049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).