N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride

C18H19ClN2O2 — CID 119680258

IUPACN-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc2c(c1)Cc1ccccc1-2)C1CC(O)CN1
InChIInChI=1S/C18H18N2O2.ClH/c21-14-9-17(19-10-14)18(22)20-13-5-6-16-12(8-13)7-11-3-1-2-4-15(11)16;/h1-6,8,14,17,19,21H,7,9-10H2,(H,20,22);1H
InChIKeyRKZBLFQBFDSYQA-UHFFFAOYSA-N
MW330.81 g/mol
LogP2.34
Rot. Bonds2

About N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride

N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119680258) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.81 g/mol. Its IUPAC name is N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
PubChem CID119680258
Molecular FormulaC18H19ClN2O2
Molecular Weight330.81 g/mol
Exact Mass330.11
IUPAC NameN-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc2c(c1)Cc1ccccc1-2)C1CC(O)CN1
InChIInChI=1S/C18H18N2O2.ClH/c21-14-9-17(19-10-14)18(22)20-13-5-6-16-12(8-13)7-11-3-1-2-4-15(11)16;/h1-6,8,14,17,19,21H,7,9-10H2,(H,20,22);1H
InChIKeyRKZBLFQBFDSYQA-UHFFFAOYSA-N
XLogP2.34
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.81
LogP ≤ 52.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride (CID 119680258) is N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride is Cl.O=C(Nc1ccc2c(c1)Cc1ccccc1-2)C1CC(O)CN1.
What is the InChIKey of N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is RKZBLFQBFDSYQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2.ClH/c21-14-9-17(19-10-14)18(22)20-13-5-6-16-12(8-13)7-11-3-1-2-4-15(11)16;/h1-6,8,14,17,19,21H,7,9-10H2,(H,20,22);1H.
What are the key properties of N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride?
N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 330.81 g/mol, XLogP of 2.34, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-2-yl)-4-hydroxypyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119680258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).