1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine

C19H21N3O — CID 139649589

IUPAC1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine
SMILESCN1CCN(C2=COc3ccc(-c4ccccn4)cc3C2)CC1
InChIInChI=1S/C19H21N3O/c1-21-8-10-22(11-9-21)17-13-16-12-15(5-6-19(16)23-14-17)18-4-2-3-7-20-18/h2-7,12,14H,8-11,13H2,1H3
InChIKeySLDUGMXUWQXYFI-UHFFFAOYSA-N
MW307.40 g/mol
LogP2.77
Rot. Bonds2

About 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine

1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine (PubChem CID 139649589) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine
PubChem CID139649589
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine
SMILESCN1CCN(C2=COc3ccc(-c4ccccn4)cc3C2)CC1
InChIInChI=1S/C19H21N3O/c1-21-8-10-22(11-9-21)17-13-16-12-15(5-6-19(16)23-14-17)18-4-2-3-7-20-18/h2-7,12,14H,8-11,13H2,1H3
InChIKeySLDUGMXUWQXYFI-UHFFFAOYSA-N
XLogP2.77
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-(4-methylpiperazin-1-yl)-3-pyridin-2-yl-1H-pyrrolo[3,2-b]pyridine
CID 175888449
6-pyridin-2-yl-3,4-dihydro-2H-chromen-3-amine;dihydrochloride
CID 146450870
methanamine;1-methyl-4-pyridin-2-ylpiperazine
CID 145148686
1-methyl-4-[2-(3-phenylphenyl)-4-pyridinyl]piperazine
CID 25218278
4-tert-butyl-6-(4-methylpiperazin-1-yl)-2-pyridin-2-ylpyrimidine
CID 155901264
2-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidine
CID 70794404
2-(4-methylpiperazin-1-yl)-N-(7-pyridin-2-ylquinazolin-2-yl)pyridine-4-carboxamide
CID 138587517
4-[3-(4-methylpiperazin-1-yl)phenyl]-1,3-oxazole
CID 176859206
1-methyl-4-pyridin-2-yl-1,4-diazepane
CID 11790022
N'-[2-(4-methylpiperazin-1-yl)phenyl]-N-[(3-pyridin-2-ylphenyl)methyl]oxamide
CID 166231717
N,N-dimethyl-3-[4-(4-methylpiperazin-1-yl)-2-pyridinyl]aniline
CID 25216821
2-[3,5-bis[6-(3-pyridin-2-ylphenyl)-2-pyridinyl]phenyl]-6-(3-pyridin-2-ylphenyl)pyridine
CID 102128660

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine?
The IUPAC name of 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine (CID 139649589) is 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine.
What is the SMILES notation for 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine?
The canonical SMILES for 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine is CN1CCN(C2=COc3ccc(-c4ccccn4)cc3C2)CC1.
What is the InChIKey of 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine?
The InChIKey is SLDUGMXUWQXYFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O/c1-21-8-10-22(11-9-21)17-13-16-12-15(5-6-19(16)23-14-17)18-4-2-3-7-20-18/h2-7,12,14H,8-11,13H2,1H3.
What are the key properties of 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine?
1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine has a molecular weight of 307.40 g/mol, XLogP of 2.77, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(6-pyridin-2-yl-4H-chromen-3-yl)piperazine is sourced from PubChem (CID 139649589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).