(3R)-3-amino-N-phenylpyrrolidine-1-carboxamide

C11H15N3O — CID 94340040

IUPAC(3R)-3-amino-N-phenylpyrrolidine-1-carboxamide
SMILESN[C@@H]1CCN(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C11H15N3O/c12-9-6-7-14(8-9)11(15)13-10-4-2-1-3-5-10/h1-5,9H,6-8,12H2,(H,13,15)/t9-/m1/s1
InChIKeyMFYRCAHFLPMSEM-SECBINFHSA-N
MW205.26 g/mol
LogP1.25
Rot. Bonds1

About (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide

(3R)-3-amino-N-phenylpyrrolidine-1-carboxamide (PubChem CID 94340040) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-3-amino-N-phenylpyrrolidine-1-carboxamide
PubChem CID94340040
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(3R)-3-amino-N-phenylpyrrolidine-1-carboxamide
SMILESN[C@@H]1CCN(C(=O)Nc2ccccc2)C1
InChIInChI=1S/C11H15N3O/c12-9-6-7-14(8-9)11(15)13-10-4-2-1-3-5-10/h1-5,9H,6-8,12H2,(H,13,15)/t9-/m1/s1
InChIKeyMFYRCAHFLPMSEM-SECBINFHSA-N
XLogP1.25
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3R)-3-aminopyrrolidine-1-carbonyl]-N-phenylpiperidine-1-carboxamide;hydrochloride
CID 119411060
3-amino-N-(4-fluorophenyl)pyrrolidine-1-carboxamide
CID 62068743
(3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride
CID 165430484
3-amino-N-(3-bromophenyl)pyrrolidine-1-carboxamide
CID 164946130
(3S)-3-amino-N-(4-cyanophenyl)pyrrolidine-1-carboxamide
CID 113282408
(3S)-3-amino-N-(3,5-dichlorophenyl)pyrrolidine-1-carboxamide
CID 107654257
1-[1-[(3R)-3-aminopyrrolidin-1-yl]-1-oxopropan-2-yl]-3-phenylurea;hydrochloride
CID 119411142
4-amino-3,3-dimethyl-N-phenylpiperidine-1-carboxamide
CID 115269781
4-benzyl-N-phenylpiperidine-1-carboxamide
CID 5064762
(3R)-3-amino-N-(2-phenoxyphenyl)pyrrolidine-1-carboxamide
CID 142326301
1-(phenylcarbamoyl)piperidine-4-carboxylate
CID 2113074
4-amino-N-(4-fluorophenyl)piperidine-1-carboxamide
CID 16773171

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide?
The IUPAC name of (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide (CID 94340040) is (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide.
What is the SMILES notation for (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide?
The canonical SMILES for (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide is N[C@@H]1CCN(C(=O)Nc2ccccc2)C1.
What is the InChIKey of (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide?
The InChIKey is MFYRCAHFLPMSEM-SECBINFHSA-N. The full InChI is InChI=1S/C11H15N3O/c12-9-6-7-14(8-9)11(15)13-10-4-2-1-3-5-10/h1-5,9H,6-8,12H2,(H,13,15)/t9-/m1/s1.
What are the key properties of (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide?
(3R)-3-amino-N-phenylpyrrolidine-1-carboxamide has a molecular weight of 205.26 g/mol, XLogP of 1.25, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-N-phenylpyrrolidine-1-carboxamide is sourced from PubChem (CID 94340040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).