2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide

C19H25N5O — CID 51093842

IUPAC2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide
SMILESCN(C)c1cc(C(=O)NCc2cccnc2N2CCCCC2)ccn1
InChIInChI=1S/C19H25N5O/c1-23(2)17-13-15(8-10-20-17)19(25)22-14-16-7-6-9-21-18(16)24-11-4-3-5-12-24/h6-10,13H,3-5,11-12,14H2,1-2H3,(H,22,25)
InChIKeyOZENUGJJQJLZIR-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.46
Rot. Bonds5

About 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide

2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide (PubChem CID 51093842) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide
PubChem CID51093842
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide
SMILESCN(C)c1cc(C(=O)NCc2cccnc2N2CCCCC2)ccn1
InChIInChI=1S/C19H25N5O/c1-23(2)17-13-15(8-10-20-17)19(25)22-14-16-7-6-9-21-18(16)24-11-4-3-5-12-24/h6-10,13H,3-5,11-12,14H2,1-2H3,(H,22,25)
InChIKeyOZENUGJJQJLZIR-UHFFFAOYSA-N
XLogP2.46
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-pyrrolidin-1-yl-3-pyridinyl)methyl]-2-[(3S)-thiolan-3-yl]oxypyridine-4-carboxamide
CID 100735448
(3S)-3-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]piperidine-1-carboxamide
CID 95762764
2-(4-methoxyphenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide
CID 51093870
2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide
CID 51093862
N-[[2-(azocan-1-yl)-3-pyridinyl]methyl]-2-(3-chloro-4-hydroxyphenyl)acetamide
CID 56752509
1-[[2-(dimethylamino)-4-pyridinyl]methyl]-3-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea
CID 55743895
2-[benzyl(methyl)amino]-N-[(2-chlorophenyl)methyl]pyridine-4-carboxamide
CID 109170290
N-[[2-(4-acetylpiperazin-1-yl)-3-pyridinyl]methyl]-3-methoxy-4-methylbenzamide
CID 42567102
1-[(4-methylnaphthalen-1-yl)methyl]-3-[(2-pyrrolidin-1-yl-3-pyridinyl)methyl]urea
CID 167827928
4-acetamido-3-methyl-N-[[2-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]benzamide
CID 56756917
2-(dimethylamino)-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 84574435
N-[(2-pyrrolidin-1-yl-3-pyridinyl)methyl]imidazo[1,2-a]pyridine-8-carboxamide
CID 167957186

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide (CID 51093842) is 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide is CN(C)c1cc(C(=O)NCc2cccnc2N2CCCCC2)ccn1.
What is the InChIKey of 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide?
The InChIKey is OZENUGJJQJLZIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-23(2)17-13-15(8-10-20-17)19(25)22-14-16-7-6-9-21-18(16)24-11-4-3-5-12-24/h6-10,13H,3-5,11-12,14H2,1-2H3,(H,22,25).
What are the key properties of 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide?
2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 51093842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).