N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide

C19H27N5O — CID 110255752

IUPACN-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide
SMILESCNC(=O)CCc1cc(C)nc(C2CCCN2Cc2ccnn2C)c1
InChIInChI=1S/C19H27N5O/c1-14-11-15(6-7-19(25)20-2)12-17(22-14)18-5-4-10-24(18)13-16-8-9-21-23(16)3/h8-9,11-12,18H,4-7,10,13H2,1-3H3,(H,20,25)
InChIKeyOFPIPPCPUTVGCK-UHFFFAOYSA-N
MW341.46 g/mol
LogP2.14
Rot. Bonds6

About N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide

N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide (PubChem CID 110255752) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide.

Molecular Properties

Compound NameN-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide
PubChem CID110255752
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC NameN-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide
SMILESCNC(=O)CCc1cc(C)nc(C2CCCN2Cc2ccnn2C)c1
InChIInChI=1S/C19H27N5O/c1-14-11-15(6-7-19(25)20-2)12-17(22-14)18-5-4-10-24(18)13-16-8-9-21-23(16)3/h8-9,11-12,18H,4-7,10,13H2,1-3H3,(H,20,25)
InChIKeyOFPIPPCPUTVGCK-UHFFFAOYSA-N
XLogP2.14
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(4-fluorophenyl)methyl]-2-methyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyridine
CID 95832568
4-[(4-fluorophenyl)methyl]-2-methyl-6-[(2R)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyridine
CID 95832569
N,2-dimethyl-6-[(2S)-1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrimidin-4-amine
CID 125008279
2-[3-[2-methyl-6-[(2R)-1-methylpyrrolidin-2-yl]-4-pyridinyl]propanoylamino]acetic acid
CID 95827134
3-[2-methyl-6-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 95820786
4,6-dimethyl-N-[3-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]pyrazin-2-yl]pyrimidin-2-amine
CID 110111786
3-[2-methyl-6-[(2S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanoic acid
CID 95827377
N-methyl-3-[2-methyl-6-(1-pyrimidin-2-ylpiperidin-4-yl)-4-pyridinyl]propanamide
CID 95820748
5-[(2R)-1-[(2-methylpyrazol-3-yl)methyl]piperidin-2-yl]pyrazolo[1,5-a]pyrimidine
CID 125014658
3-[2-(1-acetylpyrrolidin-2-yl)-6-methyl-4-pyridinyl]propanoic acid
CID 66510103
1-[(2S)-2-[6-methyl-4-(methylamino)-2-pyridinyl]morpholin-4-yl]-3-(2-methylpyrazol-3-yl)propan-1-one
CID 124955633
3-[2-[1-(cyclohexanecarbonyl)pyrrolidin-2-yl]-6-methyl-4-pyridinyl]propanoic acid
CID 110090173

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide?
The IUPAC name of N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide (CID 110255752) is N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide.
What is the SMILES notation for N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide?
The canonical SMILES for N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide is CNC(=O)CCc1cc(C)nc(C2CCCN2Cc2ccnn2C)c1.
What is the InChIKey of N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide?
The InChIKey is OFPIPPCPUTVGCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-14-11-15(6-7-19(25)20-2)12-17(22-14)18-5-4-10-24(18)13-16-8-9-21-23(16)3/h8-9,11-12,18H,4-7,10,13H2,1-3H3,(H,20,25).
What are the key properties of N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide?
N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide has a molecular weight of 341.46 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[2-methyl-6-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-2-yl]-4-pyridinyl]propanamide is sourced from PubChem (CID 110255752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).