piperidin-1-yl-(9-propylcarbazol-3-yl)methanone

C21H24N2O — CID 73354104

IUPACpiperidin-1-yl-(9-propylcarbazol-3-yl)methanone
SMILESCCCn1c2ccccc2c2cc(C(=O)N3CCCCC3)ccc21
InChIInChI=1S/C21H24N2O/c1-2-12-23-19-9-5-4-8-17(19)18-15-16(10-11-20(18)23)21(24)22-13-6-3-7-14-22/h4-5,8-11,15H,2-3,6-7,12-14H2,1H3
InChIKeyIJBUCAHOZIEBSM-UHFFFAOYSA-N
MW320.44 g/mol
LogP4.83
Rot. Bonds3

About piperidin-1-yl-(9-propylcarbazol-3-yl)methanone

piperidin-1-yl-(9-propylcarbazol-3-yl)methanone (PubChem CID 73354104) has the molecular formula C21H24N2O and a molecular weight of 320.44 g/mol. Its IUPAC name is piperidin-1-yl-(9-propylcarbazol-3-yl)methanone.

Molecular Properties

Compound Namepiperidin-1-yl-(9-propylcarbazol-3-yl)methanone
PubChem CID73354104
Molecular FormulaC21H24N2O
Molecular Weight320.44 g/mol
Exact Mass320.19
IUPAC Namepiperidin-1-yl-(9-propylcarbazol-3-yl)methanone
SMILESCCCn1c2ccccc2c2cc(C(=O)N3CCCCC3)ccc21
InChIInChI=1S/C21H24N2O/c1-2-12-23-19-9-5-4-8-17(19)18-15-16(10-11-20(18)23)21(24)22-13-6-3-7-14-22/h4-5,8-11,15H,2-3,6-7,12-14H2,1H3
InChIKeyIJBUCAHOZIEBSM-UHFFFAOYSA-N
XLogP4.83
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl-(9-propylcarbazol-3-yl)methanone?
The IUPAC name of piperidin-1-yl-(9-propylcarbazol-3-yl)methanone (CID 73354104) is piperidin-1-yl-(9-propylcarbazol-3-yl)methanone.
What is the SMILES notation for piperidin-1-yl-(9-propylcarbazol-3-yl)methanone?
The canonical SMILES for piperidin-1-yl-(9-propylcarbazol-3-yl)methanone is CCCn1c2ccccc2c2cc(C(=O)N3CCCCC3)ccc21.
What is the InChIKey of piperidin-1-yl-(9-propylcarbazol-3-yl)methanone?
The InChIKey is IJBUCAHOZIEBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O/c1-2-12-23-19-9-5-4-8-17(19)18-15-16(10-11-20(18)23)21(24)22-13-6-3-7-14-22/h4-5,8-11,15H,2-3,6-7,12-14H2,1H3.
What are the key properties of piperidin-1-yl-(9-propylcarbazol-3-yl)methanone?
piperidin-1-yl-(9-propylcarbazol-3-yl)methanone has a molecular weight of 320.44 g/mol, XLogP of 4.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl-(9-propylcarbazol-3-yl)methanone is sourced from PubChem (CID 73354104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).