2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide

C19H19N5O — CID 142792038

IUPAC2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide
SMILESNC(=O)C(c1cccnc1)N(Cc1ccncc1)Cc1cccnc1
InChIInChI=1S/C19H19N5O/c20-19(25)18(17-4-2-8-23-12-17)24(13-15-5-9-21-10-6-15)14-16-3-1-7-22-11-16/h1-12,18H,13-14H2,(H2,20,25)
InChIKeyVLUOGRLUBGRPKB-UHFFFAOYSA-N
MW333.40 g/mol
LogP2.10
Rot. Bonds7

About 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide

2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide (PubChem CID 142792038) has the molecular formula C19H19N5O and a molecular weight of 333.40 g/mol. Its IUPAC name is 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide.

Molecular Properties

Compound Name2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide
PubChem CID142792038
Molecular FormulaC19H19N5O
Molecular Weight333.40 g/mol
Exact Mass333.16
IUPAC Name2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide
SMILESNC(=O)C(c1cccnc1)N(Cc1ccncc1)Cc1cccnc1
InChIInChI=1S/C19H19N5O/c20-19(25)18(17-4-2-8-23-12-17)24(13-15-5-9-21-10-6-15)14-16-3-1-7-22-11-16/h1-12,18H,13-14H2,(H2,20,25)
InChIKeyVLUOGRLUBGRPKB-UHFFFAOYSA-N
XLogP2.10
TPSA85.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.40
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-chlorophenyl)-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide
CID 142791990
2-[bis(pyridin-3-ylmethyl)amino]-2-(4-bromophenyl)acetamide
CID 142791812
2-(3-methylthiophen-2-yl)-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide
CID 142792019
2-(3-bromophenyl)-2-[2-pyridin-3-ylethyl(2-pyridin-4-ylethyl)amino]acetamide
CID 142792081
2-(dimethylamino)-2-pyridin-3-ylacetamide;dihydrochloride
CID 67492420
1-amino-1-(pyridin-3-ylmethyl)urea
CID 155026143
(2S)-2-(3-bromophenyl)-2-[methyl(pyridin-3-ylmethyl)amino]acetamide
CID 97331831
N-benzyl-2-(dimethylamino)-N-methyl-2-pyridin-3-ylacetamide
CID 110753905
2-phenyl-3-pyridin-3-ylpropanamide
CID 171502842
2-(diethylamino)-2-pyridin-3-ylacetic acid
CID 43803724
N-methyl-1-pyridin-3-yl-N-(pyridin-4-ylmethyl)ethane-1,2-diamine
CID 43563998
N-methyl-2-pyridin-3-ylacetohydrazide
CID 116844877

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide?
The IUPAC name of 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide (CID 142792038) is 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide.
What is the SMILES notation for 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide?
The canonical SMILES for 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide is NC(=O)C(c1cccnc1)N(Cc1ccncc1)Cc1cccnc1.
What is the InChIKey of 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide?
The InChIKey is VLUOGRLUBGRPKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O/c20-19(25)18(17-4-2-8-23-12-17)24(13-15-5-9-21-10-6-15)14-16-3-1-7-22-11-16/h1-12,18H,13-14H2,(H2,20,25).
What are the key properties of 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide?
2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide has a molecular weight of 333.40 g/mol, XLogP of 2.10, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-2-[pyridin-3-ylmethyl(pyridin-4-ylmethyl)amino]acetamide is sourced from PubChem (CID 142792038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).