N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride

C14H21ClN2O2 — CID 119280457

IUPACN-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCC(C)Oc1ccc(NC(=O)C2CCCN2)cc1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-10(2)18-12-7-5-11(6-8-12)16-14(17)13-4-3-9-15-13;/h5-8,10,13,15H,3-4,9H2,1-2H3,(H,16,17);1H
InChIKeyRBLUEOUWYQANQS-UHFFFAOYSA-N
MW284.79 g/mol
LogP2.59
Rot. Bonds4

About N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride

N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119280457) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119280457
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC NameN-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCC(C)Oc1ccc(NC(=O)C2CCCN2)cc1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-10(2)18-12-7-5-11(6-8-12)16-14(17)13-4-3-9-15-13;/h5-8,10,13,15H,3-4,9H2,1-2H3,(H,16,17);1H
InChIKeyRBLUEOUWYQANQS-UHFFFAOYSA-N
XLogP2.59
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride 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-(3-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide
CID 82044662
N-(4-methoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 56832268
(2S)-N-(4-acetamidophenyl)pyrrolidine-2-carboxamide
CID 22691413
methyl N-[4-(pyrrolidine-2-carbonylamino)phenyl]carbamate
CID 43712644
(2S)-N-[4-(2-methylpropanoylamino)phenyl]piperidine-2-carboxamide
CID 103808067
(2R)-N-[4-(propan-2-ylcarbamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119740054
N-[4-(3-methylbutanoylamino)phenyl]pyrrolidine-2-carboxamide
CID 60727380
N-(4-aminophenyl)pyrrolidine-2-carboxamide
CID 22034800
(2R)-N-(4-phenoxyphenyl)piperidine-2-carboxamide;hydrochloride
CID 119671696
N-[4-[(2-methylpropan-2-yl)oxy]phenyl]piperidine-2-carboxamide
CID 110462338
2-[4-[[(2R)-pyrrolidine-2-carbonyl]amino]phenoxy]acetic acid
CID 104901157
(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119670939

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride (CID 119280457) is N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride is CC(C)Oc1ccc(NC(=O)C2CCCN2)cc1.Cl.
What is the InChIKey of N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is RBLUEOUWYQANQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2.ClH/c1-10(2)18-12-7-5-11(6-8-12)16-14(17)13-4-3-9-15-13;/h5-8,10,13,15H,3-4,9H2,1-2H3,(H,16,17);1H.
What are the key properties of N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride?
N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 284.79 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yloxyphenyl)pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119280457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).