N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide

C26H32N4O2 — CID 24951082

IUPACN-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide
SMILESCN(C(=O)c1ccccn1)C1CCN(c2ccc(C(=O)N3CC4CCC(CC4)C3)cc2)C1
InChIInChI=1S/C26H32N4O2/c1-28(26(32)24-4-2-3-14-27-24)23-13-15-29(18-23)22-11-9-21(10-12-22)25(31)30-16-19-5-6-20(17-30)8-7-19/h2-4,9-12,14,19-20,23H,5-8,13,15-18H2,1H3
InChIKeyFQYUNVKTPUMEBD-UHFFFAOYSA-N
MW432.57 g/mol
LogP3.69
Rot. Bonds4

About N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide

N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide (PubChem CID 24951082) has the molecular formula C26H32N4O2 and a molecular weight of 432.57 g/mol. Its IUPAC name is N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide
PubChem CID24951082
Molecular FormulaC26H32N4O2
Molecular Weight432.57 g/mol
Exact Mass432.25
IUPAC NameN-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide
SMILESCN(C(=O)c1ccccn1)C1CCN(c2ccc(C(=O)N3CC4CCC(CC4)C3)cc2)C1
InChIInChI=1S/C26H32N4O2/c1-28(26(32)24-4-2-3-14-27-24)23-13-15-29(18-23)22-11-9-21(10-12-22)25(31)30-16-19-5-6-20(17-30)8-7-19/h2-4,9-12,14,19-20,23H,5-8,13,15-18H2,1H3
InChIKeyFQYUNVKTPUMEBD-UHFFFAOYSA-N
XLogP3.69
TPSA56.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.57
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-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-(4-hydroxycyclohexyl)-N-methylpyridine-2-carboxamide
CID 115277407
N-cyclobutyl-N-methylpyridine-2-carboxamide
CID 126857014
3-azabicyclo[3.2.2]nonan-3-yl-[4-(3-phenylmethoxypyrrolidin-1-yl)phenyl]methanone
CID 24957914
N,6-dimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-2-carboxamide
CID 124981919
[(4R)-4-(dimethylamino)azepan-1-yl]-pyridin-2-ylmethanone
CID 95710719
N-cyclohexyl-4-[(3R)-3-hydroxypyrrolidin-1-yl]-N-methylpyridine-2-carboxamide
CID 56912622
[3-(dimethylamino)pyrrolidin-1-yl]-[4-(pyridin-2-ylamino)phenyl]methanone
CID 24794840
1-[(3S)-1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-4-methylpentan-2-one
CID 58044840
4-ethyl-N-methyl-N-(1-pyridin-2-ylpiperidin-4-yl)benzamide
CID 47091378
N-methyl-N-[(1R)-1-[1-(4-methylsulfanylbenzoyl)piperidin-4-yl]-2-phenylethyl]pyridine-2-carboxamide
CID 42406587
[(3S,4R)-3-hydroxy-4-(pyridin-2-ylmethyl)pyrrolidin-1-yl]-[4-(4-methylpiperazin-1-yl)phenyl]methanone
CID 134703358
(3-aminopyrrolidin-1-yl)-pyridin-2-ylmethanone
CID 59657975

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide?
The IUPAC name of N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide (CID 24951082) is N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide?
The canonical SMILES for N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide is CN(C(=O)c1ccccn1)C1CCN(c2ccc(C(=O)N3CC4CCC(CC4)C3)cc2)C1.
What is the InChIKey of N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide?
The InChIKey is FQYUNVKTPUMEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N4O2/c1-28(26(32)24-4-2-3-14-27-24)23-13-15-29(18-23)22-11-9-21(10-12-22)25(31)30-16-19-5-6-20(17-30)8-7-19/h2-4,9-12,14,19-20,23H,5-8,13,15-18H2,1H3.
What are the key properties of N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide?
N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide has a molecular weight of 432.57 g/mol, XLogP of 3.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(3-azabicyclo[3.2.2]nonane-3-carbonyl)phenyl]pyrrolidin-3-yl]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 24951082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).