N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide

C19H19N5O2 — CID 166349219

IUPACN-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide
SMILESO=C(CNC(=O)CNc1ccnc2cnccc12)NCc1ccccc1
InChIInChI=1S/C19H19N5O2/c25-18(24-13-19(26)23-10-14-4-2-1-3-5-14)12-22-16-7-9-21-17-11-20-8-6-15(16)17/h1-9,11H,10,12-13H2,(H,21,22)(H,23,26)(H,24,25)
InChIKeyXCDNHRGASJPIFQ-UHFFFAOYSA-N
MW349.39 g/mol
LogP1.47
Rot. Bonds7

About N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide

N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide (PubChem CID 166349219) has the molecular formula C19H19N5O2 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide.

Molecular Properties

Compound NameN-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide
PubChem CID166349219
Molecular FormulaC19H19N5O2
Molecular Weight349.39 g/mol
Exact Mass349.15
IUPAC NameN-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide
SMILESO=C(CNC(=O)CNc1ccnc2cnccc12)NCc1ccccc1
InChIInChI=1S/C19H19N5O2/c25-18(24-13-19(26)23-10-14-4-2-1-3-5-14)12-22-16-7-9-21-17-11-20-8-6-15(16)17/h1-9,11H,10,12-13H2,(H,21,22)(H,23,26)(H,24,25)
InChIKeyXCDNHRGASJPIFQ-UHFFFAOYSA-N
XLogP1.47
TPSA96.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 51.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methylanilino)-N-(pyridin-3-ylmethyl)acetamide
CID 108999506
N-[2-(benzylamino)-2-oxoethyl]-4-chloropyridine-3-carboxamide
CID 81229372
N-benzyl-2-(pyrazin-2-ylmethylamino)acetamide
CID 62763065
N-(pyridin-3-ylmethyl)-2-(quinazolin-4-ylamino)acetamide
CID 110436040
2-(2,3-dichloroanilino)-N-(pyridin-3-ylmethyl)acetamide
CID 108999597
2-(quinolin-4-ylamino)acetamide
CID 61340443
N-(2-pyridin-3-ylethyl)quinolin-4-amine
CID 61339909
N-benzyl-2-(2-methylsulfanylanilino)acetamide
CID 51252968
N-benzyl-2-(2,4,5-trifluoroanilino)acetamide
CID 62815218
4-tert-butyl-N-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]benzamide
CID 27554699
2-(benzylamino)-N-[4-(quinolin-4-ylamino)butyl]benzamide
CID 162368751
2-amino-N-[2-oxo-2-(pyridin-4-ylmethylamino)ethyl]acetamide
CID 60848280

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide?
The IUPAC name of N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide (CID 166349219) is N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide.
What is the SMILES notation for N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide?
The canonical SMILES for N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide is O=C(CNC(=O)CNc1ccnc2cnccc12)NCc1ccccc1.
What is the InChIKey of N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide?
The InChIKey is XCDNHRGASJPIFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O2/c25-18(24-13-19(26)23-10-14-4-2-1-3-5-14)12-22-16-7-9-21-17-11-20-8-6-15(16)17/h1-9,11H,10,12-13H2,(H,21,22)(H,23,26)(H,24,25).
What are the key properties of N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide?
N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide has a molecular weight of 349.39 g/mol, XLogP of 1.47, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(benzylamino)-2-oxoethyl]-2-(1,7-naphthyridin-4-ylamino)acetamide is sourced from PubChem (CID 166349219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).