carbamic acid;1-phenylpiperidine

C12H18N2O2 — CID 161473217

IUPACcarbamic acid;1-phenylpiperidine
SMILESNC(=O)O.c1ccc(N2CCCCC2)cc1
InChIInChI=1S/C11H15N.CH3NO2/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;2-1(3)4/h1,3-4,7-8H,2,5-6,9-10H2;2H2,(H,3,4)
InChIKeyWDJCQKHIFGURNT-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.30
Rot. Bonds1

About carbamic acid;1-phenylpiperidine

carbamic acid;1-phenylpiperidine (PubChem CID 161473217) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is carbamic acid;1-phenylpiperidine.

Molecular Properties

Compound Namecarbamic acid;1-phenylpiperidine
PubChem CID161473217
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Namecarbamic acid;1-phenylpiperidine
SMILESNC(=O)O.c1ccc(N2CCCCC2)cc1
InChIInChI=1S/C11H15N.CH3NO2/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;2-1(3)4/h1,3-4,7-8H,2,5-6,9-10H2;2H2,(H,3,4)
InChIKeyWDJCQKHIFGURNT-UHFFFAOYSA-N
XLogP2.30
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenylpiperidine;phosphenous acid
CID 174871848
butanamide;1-phenylpiperidine
CID 174698826
ethane;methanol;1-phenylpiperidine
CID 177175072
1-(4-phenylpiperazin-1-yl)-2-piperidin-1-ylethane-1,2-dione
CID 2200683
(2S)-2-amino-3-methylbutanoic acid;1-phenylpyrrolidine
CID 67230654
1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449
1-phenyl-4-piperidin-1-ylimidazole-2-carboxamide
CID 67993061
N-phenyl-4-piperidin-1-ylbenzamide
CID 53282261
[2-(4-phenylpiperazine-1-carbonyl)cyclopropyl]-piperidin-1-ylmethanone
CID 109132218
methylcyclohexane;1-phenylpiperidine
CID 174582589
ethoxyethane;1-phenylpiperidine
CID 174883082
1-(4-piperidin-1-ylphenyl)cyclopropane-1-carboxylic acid
CID 112558554

Frequently Asked Questions

What is the IUPAC name of carbamic acid;1-phenylpiperidine?
The IUPAC name of carbamic acid;1-phenylpiperidine (CID 161473217) is carbamic acid;1-phenylpiperidine.
What is the SMILES notation for carbamic acid;1-phenylpiperidine?
The canonical SMILES for carbamic acid;1-phenylpiperidine is NC(=O)O.c1ccc(N2CCCCC2)cc1.
What is the InChIKey of carbamic acid;1-phenylpiperidine?
The InChIKey is WDJCQKHIFGURNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N.CH3NO2/c1-3-7-11(8-4-1)12-9-5-2-6-10-12;2-1(3)4/h1,3-4,7-8H,2,5-6,9-10H2;2H2,(H,3,4).
What are the key properties of carbamic acid;1-phenylpiperidine?
carbamic acid;1-phenylpiperidine has a molecular weight of 222.29 g/mol, XLogP of 2.30, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbamic acid;1-phenylpiperidine is sourced from PubChem (CID 161473217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).