7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide

C21H26N4O2 — CID 167947516

IUPAC7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide
SMILESCOc1cccc2c1C(C(=O)Nc1ccc(N3CCN(C)CC3)cn1)CC2
InChIInChI=1S/C21H26N4O2/c1-24-10-12-25(13-11-24)16-7-9-19(22-14-16)23-21(26)17-8-6-15-4-3-5-18(27-2)20(15)17/h3-5,7,9,14,17H,6,8,10-13H2,1-2H3,(H,22,23,26)
InChIKeyDTTXPPAMUQTTDG-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.51
Rot. Bonds4

About 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide

7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide (PubChem CID 167947516) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide
PubChem CID167947516
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC Name7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide
SMILESCOc1cccc2c1C(C(=O)Nc1ccc(N3CCN(C)CC3)cn1)CC2
InChIInChI=1S/C21H26N4O2/c1-24-10-12-25(13-11-24)16-7-9-19(22-14-16)23-21(26)17-8-6-15-4-3-5-18(27-2)20(15)17/h3-5,7,9,14,17H,6,8,10-13H2,1-2H3,(H,22,23,26)
InChIKeyDTTXPPAMUQTTDG-UHFFFAOYSA-N
XLogP2.51
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide?
The IUPAC name of 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide (CID 167947516) is 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide.
What is the SMILES notation for 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide?
The canonical SMILES for 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide is COc1cccc2c1C(C(=O)Nc1ccc(N3CCN(C)CC3)cn1)CC2.
What is the InChIKey of 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide?
The InChIKey is DTTXPPAMUQTTDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-24-10-12-25(13-11-24)16-7-9-19(22-14-16)23-21(26)17-8-6-15-4-3-5-18(27-2)20(15)17/h3-5,7,9,14,17H,6,8,10-13H2,1-2H3,(H,22,23,26).
What are the key properties of 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide?
7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]-2,3-dihydro-1H-indene-1-carboxamide is sourced from PubChem (CID 167947516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).