[4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone

C24H25N3O3 — CID 655901

IUPAC[4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(CC(O)Cn2c3ccccc3c3ccccc32)CC1
InChIInChI=1S/C24H25N3O3/c28-18(16-25-11-13-26(14-12-25)24(29)23-10-5-15-30-23)17-27-21-8-3-1-6-19(21)20-7-2-4-9-22(20)27/h1-10,15,18,28H,11-14,16-17H2
InChIKeyQZNOGWXLGHKSCQ-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.21
Rot. Bonds5

About [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone

[4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone (PubChem CID 655901) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone
PubChem CID655901
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC Name[4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(CC(O)Cn2c3ccccc3c3ccccc32)CC1
InChIInChI=1S/C24H25N3O3/c28-18(16-25-11-13-26(14-12-25)24(29)23-10-5-15-30-23)17-27-21-8-3-1-6-19(21)20-7-2-4-9-22(20)27/h1-10,15,18,28H,11-14,16-17H2
InChIKeyQZNOGWXLGHKSCQ-UHFFFAOYSA-N
XLogP3.21
TPSA61.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

KL001
CID 2888648
1-(9H-carbazol-9-yl)-3-(((furan-2-yl)methyl)amino)propan-2-ol
CID 652652
1-(2,6-dimethyl-1H-indol-3-yl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone
CID 1932249
2-(2-Furoyl)-1-phenyl-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazine
CID 4917368
(6-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]methanone
CID 652786
1-(4-fluoro-1H-indol-3-yl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]ethane-1,2-dione
CID 506359
2-Furyl[4-(2-methylquinolin-4-yl)piperazino]methanone
CID 2728457
1-[4-(furan-2-carbonyl)piperazin-1-yl]-2-(2-methyl-1H-indol-3-yl)ethane-1,2-dione
CID 7117518
(E)-N-(2-(2-((2-methyl-1H-indol-3-yl)methylene)hydrazinyl)-2-oxoethyl)furan-2-carboxamide
CID 135650466
N-[2-(1H-indol-3-yl)ethyl]furan-2-carboxamide
CID 744531
N-[(1Z)-1-(furan-2-yl)-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]furan-2-carboxamide
CID 1597875
2-(4-(furan-2-carbonyl)piperazin-1-yl)-1-(2-methyl-1H-indol-3-yl)ethanone
CID 2016055

Frequently Asked Questions

What is the IUPAC name of [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone?
The IUPAC name of [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone (CID 655901) is [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone?
The canonical SMILES for [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone is O=C(c1ccco1)N1CCN(CC(O)Cn2c3ccccc3c3ccccc32)CC1.
What is the InChIKey of [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone?
The InChIKey is QZNOGWXLGHKSCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c28-18(16-25-11-13-26(14-12-25)24(29)23-10-5-15-30-23)17-27-21-8-3-1-6-19(21)20-7-2-4-9-22(20)27/h1-10,15,18,28H,11-14,16-17H2.
What are the key properties of [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone?
[4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone has a molecular weight of 403.48 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-carbazol-9-yl-2-hydroxypropyl)piperazin-1-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 655901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).