phenyl(pyrrolidin-1-yl)carbamic acid

C11H14N2O2 — CID 67619544

IUPACphenyl(pyrrolidin-1-yl)carbamic acid
SMILESO=C(O)N(c1ccccc1)N1CCCC1
InChIInChI=1S/C11H14N2O2/c14-11(15)13(12-8-4-5-9-12)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,14,15)
InChIKeyLDLLBCMQRBUQKC-UHFFFAOYSA-N
MW206.25 g/mol
LogP2.18
Rot. Bonds2

About phenyl(pyrrolidin-1-yl)carbamic acid

phenyl(pyrrolidin-1-yl)carbamic acid (PubChem CID 67619544) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is phenyl(pyrrolidin-1-yl)carbamic acid.

Molecular Properties

Compound Namephenyl(pyrrolidin-1-yl)carbamic acid
PubChem CID67619544
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Namephenyl(pyrrolidin-1-yl)carbamic acid
SMILESO=C(O)N(c1ccccc1)N1CCCC1
InChIInChI=1S/C11H14N2O2/c14-11(15)13(12-8-4-5-9-12)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,14,15)
InChIKeyLDLLBCMQRBUQKC-UHFFFAOYSA-N
XLogP2.18
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide
CID 154157313
N-ethyl-N'-phenyl-N'-pyrrolidin-1-yloxamide
CID 173109987
2-[phenyl-(N-pyrrolidin-1-ylanilino)methylidene]propanedinitrile
CID 11099060
N-methyl-N-phenylpiperidine-1-carboxamide
CID 54133936
2-(N'-ethylcarbamimidoyl)-1-phenyl-1-piperidin-1-ylguanidine
CID 174723354
N-[diphenyl-[N-(pyrrolidine-1-carbonyl)anilino]silyl]-N-phenylpyrrolidine-1-carboxamide
CID 71363862
ethyl 1-(N-propanoylanilino)piperidine-4-carboxylate
CID 151371573
pyrrolidin-1-yl(triphenylstannyl)methanone
CID 14028202
N,N-diphenyl-4-(piperidine-1-carbonyl)piperazine-1-carboxamide
CID 991675
(3,4-dimethyl-2-oxoimidazolidin-1-yl)-phenylcarbamic acid
CID 70524007
cobalt;bis(diphenylcarbamic acid)
CID 155679078
N-ethyl-N-phenylpiperidine-1-carboxamide
CID 108987918

Frequently Asked Questions

What is the IUPAC name of phenyl(pyrrolidin-1-yl)carbamic acid?
The IUPAC name of phenyl(pyrrolidin-1-yl)carbamic acid (CID 67619544) is phenyl(pyrrolidin-1-yl)carbamic acid.
What is the SMILES notation for phenyl(pyrrolidin-1-yl)carbamic acid?
The canonical SMILES for phenyl(pyrrolidin-1-yl)carbamic acid is O=C(O)N(c1ccccc1)N1CCCC1.
What is the InChIKey of phenyl(pyrrolidin-1-yl)carbamic acid?
The InChIKey is LDLLBCMQRBUQKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c14-11(15)13(12-8-4-5-9-12)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,14,15).
What are the key properties of phenyl(pyrrolidin-1-yl)carbamic acid?
phenyl(pyrrolidin-1-yl)carbamic acid has a molecular weight of 206.25 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(pyrrolidin-1-yl)carbamic acid is sourced from PubChem (CID 67619544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).