N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide

C11H15N3O — CID 81409992

IUPACN-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide
SMILESC[C@@H](NC(=O)C1CNC1)c1ccncc1
InChIInChI=1S/C11H15N3O/c1-8(9-2-4-12-5-3-9)14-11(15)10-6-13-7-10/h2-5,8,10,13H,6-7H2,1H3,(H,14,15)/t8-/m1/s1
InChIKeyJCBLTTBRAYTFKI-MRVPVSSYSA-N
MW205.26 g/mol
LogP0.48
Rot. Bonds3

About N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide

N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide (PubChem CID 81409992) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide
PubChem CID81409992
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC NameN-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide
SMILESC[C@@H](NC(=O)C1CNC1)c1ccncc1
InChIInChI=1S/C11H15N3O/c1-8(9-2-4-12-5-3-9)14-11(15)10-6-13-7-10/h2-5,8,10,13H,6-7H2,1H3,(H,14,15)/t8-/m1/s1
InChIKeyJCBLTTBRAYTFKI-MRVPVSSYSA-N
XLogP0.48
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1R)-1-phenylethyl]azetidine-3-carboxamide
CID 79026254
6-oxo-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
CID 71652098
2-(azetidin-3-yl)-N-(1-pyridin-4-ylethyl)acetamide
CID 64616162
2-(azetidin-3-yl)-N-[(1R)-1-pyridin-4-ylethyl]acetamide
CID 81409827
N-[(1R)-1-thiophen-2-ylethyl]azetidine-3-carboxamide
CID 81407911
N-(1-phenylethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119669719
N-[(1S)-1-pyridin-4-ylethyl]-1,3-thiazolidine-4-carboxamide
CID 81410670
N-[(1R)-1-pyridin-4-ylethyl]piperidine-2-carboxamide
CID 81410506
(2S,3R)-3-[[(1S)-1-pyridin-4-ylethyl]carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
CID 27492443
cis-(1S,2R)-2-[[(1S)-1-pyridin-4-ylethyl]carbamoyl]cyclopentane-1-carboxylic acid
CID 114092665
6-[[(1R)-1-pyridin-4-ylethyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 81404994
N-[(1S)-1-(4-fluorophenyl)ethyl]pyrrolidine-3-carboxamide
CID 81350122

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide?
The IUPAC name of N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide (CID 81409992) is N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide.
What is the SMILES notation for N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide?
The canonical SMILES for N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide is C[C@@H](NC(=O)C1CNC1)c1ccncc1.
What is the InChIKey of N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide?
The InChIKey is JCBLTTBRAYTFKI-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8(9-2-4-12-5-3-9)14-11(15)10-6-13-7-10/h2-5,8,10,13H,6-7H2,1H3,(H,14,15)/t8-/m1/s1.
What are the key properties of N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide?
N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide has a molecular weight of 205.26 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-pyridin-4-ylethyl]azetidine-3-carboxamide is sourced from PubChem (CID 81409992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).