[1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid

C19H20N2O2 — CID 126674115

IUPAC[1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid
SMILESO=C(O)NC1CCCN(C2c3ccccc3-c3ccccc32)C1
InChIInChI=1S/C19H20N2O2/c22-19(23)20-13-6-5-11-21(12-13)18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,13,18,20H,5-6,11-12H2,(H,22,23)
InChIKeyZDKIVYVATRCUMT-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.49
Rot. Bonds2

About [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid

[1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid (PubChem CID 126674115) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid.

Molecular Properties

Compound Name[1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid
PubChem CID126674115
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name[1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid
SMILESO=C(O)NC1CCCN(C2c3ccccc3-c3ccccc32)C1
InChIInChI=1S/C19H20N2O2/c22-19(23)20-13-6-5-11-21(12-13)18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,13,18,20H,5-6,11-12H2,(H,22,23)
InChIKeyZDKIVYVATRCUMT-UHFFFAOYSA-N
XLogP3.49
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3R)-1-(9H-fluoren-9-yl)piperidin-3-yl]methanesulfonamide
CID 52534632
(1-cyclopropylpiperidin-3-yl)carbamic acid
CID 170157266
[(3R)-1-phenylpiperidin-3-yl]carbamic acid
CID 89499357
N-[1-(9H-fluoren-9-yl)piperidin-3-yl]-6-methoxy-5-(4-methylimidazol-1-yl)pyridine-2-carboxamide
CID 52934695
N-[1-(1-hydroxy-2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-2-methylpropanamide
CID 84598887
[(3R)-1-methylpiperidin-3-yl]carbamic acid
CID 175691082
[(3S)-1-methylpiperidin-3-yl]carbamic acid
CID 172824480
4-[(3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)piperidin-1-yl]benzoic acid
CID 125422013
(1-phenylpiperidin-3-yl)urea
CID 121416777
1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine
CID 63263215
9H-fluoren-9-ylmethyl (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]piperidine-1-carboxylate
CID 124585179
9H-fluoren-9-ylmethyl (3R)-3-(cyclopropylamino)piperidine-1-carboxylate
CID 170555045

Frequently Asked Questions

What is the IUPAC name of [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid?
The IUPAC name of [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid (CID 126674115) is [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid.
What is the SMILES notation for [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid?
The canonical SMILES for [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid is O=C(O)NC1CCCN(C2c3ccccc3-c3ccccc32)C1.
What is the InChIKey of [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid?
The InChIKey is ZDKIVYVATRCUMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-19(23)20-13-6-5-11-21(12-13)18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,13,18,20H,5-6,11-12H2,(H,22,23).
What are the key properties of [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid?
[1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid has a molecular weight of 308.38 g/mol, XLogP of 3.49, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(9H-fluoren-9-yl)piperidin-3-yl]carbamic acid is sourced from PubChem (CID 126674115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).