(2R)-N-(3-anilinopropyl)piperidine-2-carboxamide

C15H23N3O — CID 119867761

IUPAC(2R)-N-(3-anilinopropyl)piperidine-2-carboxamide
SMILESO=C(NCCCNc1ccccc1)[C@H]1CCCCN1
InChIInChI=1S/C15H23N3O/c19-15(14-9-4-5-10-17-14)18-12-6-11-16-13-7-2-1-3-8-13/h1-3,7-8,14,16-17H,4-6,9-12H2,(H,18,19)/t14-/m1/s1
InChIKeyQFNIBZSTUXDVMJ-CQSZACIVSA-N
MW261.37 g/mol
LogP1.75
Rot. Bonds6

About (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide

(2R)-N-(3-anilinopropyl)piperidine-2-carboxamide (PubChem CID 119867761) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(3-anilinopropyl)piperidine-2-carboxamide
PubChem CID119867761
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name(2R)-N-(3-anilinopropyl)piperidine-2-carboxamide
SMILESO=C(NCCCNc1ccccc1)[C@H]1CCCCN1
InChIInChI=1S/C15H23N3O/c19-15(14-9-4-5-10-17-14)18-12-6-11-16-13-7-2-1-3-8-13/h1-3,7-8,14,16-17H,4-6,9-12H2,(H,18,19)/t14-/m1/s1
InChIKeyQFNIBZSTUXDVMJ-CQSZACIVSA-N
XLogP1.75
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-anilino-3-oxopropyl)piperidine-2-carboxamide;hydrochloride
CID 119324861
(2S)-N-(3-phenylpropyl)pyrrolidine-2-carboxamide
CID 14234527
(2S)-N-(2-phenoxyethyl)piperidine-2-carboxamide
CID 58563871
N-(2-phenoxyethyl)piperidine-2-carboxamide
CID 55017247
(2S)-N-phenylpiperidine-2-carboxamide;hydrochloride
CID 68574355
N-[3-(N-ethylanilino)propyl]piperidine-2-carboxamide
CID 61259552
N-(2-phenoxyethyl)azepane-2-carboxamide
CID 64562494
N-(3-phenoxypropyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119274134
N-benzylpiperidine-2-carboxamide;hydrochloride
CID 53410820
N-[4-(1,3-dihydroisoindol-2-yl)-4-oxobutyl]piperidine-2-carboxamide
CID 119323819
(2S)-N-(2-methyl-2-phenylpropyl)piperidine-2-carboxamide
CID 93398876
(2R)-N'-phenylpiperidine-2-carbohydrazide
CID 124707340

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide?
The IUPAC name of (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide (CID 119867761) is (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide.
What is the SMILES notation for (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide?
The canonical SMILES for (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide is O=C(NCCCNc1ccccc1)[C@H]1CCCCN1.
What is the InChIKey of (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide?
The InChIKey is QFNIBZSTUXDVMJ-CQSZACIVSA-N. The full InChI is InChI=1S/C15H23N3O/c19-15(14-9-4-5-10-17-14)18-12-6-11-16-13-7-2-1-3-8-13/h1-3,7-8,14,16-17H,4-6,9-12H2,(H,18,19)/t14-/m1/s1.
What are the key properties of (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide?
(2R)-N-(3-anilinopropyl)piperidine-2-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 1.75, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-anilinopropyl)piperidine-2-carboxamide is sourced from PubChem (CID 119867761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).