N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride

C11H17Cl2N3O — CID 119551120

IUPACN-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride
SMILESCN(C(=O)c1ccncc1)C1CCNC1.Cl.Cl
InChIInChI=1S/C11H15N3O.2ClH/c1-14(10-4-7-13-8-10)11(15)9-2-5-12-6-3-9;;/h2-3,5-6,10,13H,4,7-8H2,1H3;2*1H
InChIKeyYDVNFPOOJUUJSS-UHFFFAOYSA-N
MW278.18 g/mol
LogP1.36
Rot. Bonds2

About N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride

N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride (PubChem CID 119551120) has the molecular formula C11H17Cl2N3O and a molecular weight of 278.18 g/mol. Its IUPAC name is N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride
PubChem CID119551120
Molecular FormulaC11H17Cl2N3O
Molecular Weight278.18 g/mol
Exact Mass277.07
IUPAC NameN-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride
SMILESCN(C(=O)c1ccncc1)C1CCNC1.Cl.Cl
InChIInChI=1S/C11H15N3O.2ClH/c1-14(10-4-7-13-8-10)11(15)9-2-5-12-6-3-9;;/h2-3,5-6,10,13H,4,7-8H2,1H3;2*1H
InChIKeyYDVNFPOOJUUJSS-UHFFFAOYSA-N
XLogP1.36
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.18
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride 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

4-acetamido-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119549858
N,3,5-trimethyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119551819
N,3,4-trimethyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119554368
4-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119550546
4-(4-ethylphenyl)-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 21034256
N-methyl-4-[methyl(propyl)amino]-N-pyrrolidin-3-ylbenzamide;dihydrochloride
CID 119554876
4-(cyclopropanecarbonylamino)-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119554246
N-[2-methyl-6-[methyl(pyrrolidin-3-yl)carbamoyl]phenyl]pyridine-4-carboxamide
CID 119551533
N-methyl-5-phenyl-N-pyrrolidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119552361
4-(methoxymethyl)-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 119553670
4-ethylsulfonyl-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 119554037
4-(cyclopropylmethoxy)-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119551835

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride?
The IUPAC name of N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride (CID 119551120) is N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride.
What is the SMILES notation for N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride?
The canonical SMILES for N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride is CN(C(=O)c1ccncc1)C1CCNC1.Cl.Cl.
What is the InChIKey of N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride?
The InChIKey is YDVNFPOOJUUJSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O.2ClH/c1-14(10-4-7-13-8-10)11(15)9-2-5-12-6-3-9;;/h2-3,5-6,10,13H,4,7-8H2,1H3;2*1H.
What are the key properties of N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride?
N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride has a molecular weight of 278.18 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 119551120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).