N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide

C16H17N5O — CID 23036184

IUPACN-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide
SMILESO=C(CNc1ccncc1)Nc1ccccc1N1C=NCC1
InChIInChI=1S/C16H17N5O/c22-16(11-19-13-5-7-17-8-6-13)20-14-3-1-2-4-15(14)21-10-9-18-12-21/h1-8,12H,9-11H2,(H,17,19)(H,20,22)
InChIKeyQQKYXSZIXOUJFW-UHFFFAOYSA-N
MW295.35 g/mol
LogP1.98
Rot. Bonds5

About N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide

N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide (PubChem CID 23036184) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide.

Molecular Properties

Compound NameN-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide
PubChem CID23036184
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC NameN-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide
SMILESO=C(CNc1ccncc1)Nc1ccccc1N1C=NCC1
InChIInChI=1S/C16H17N5O/c22-16(11-19-13-5-7-17-8-6-13)20-14-3-1-2-4-15(14)21-10-9-18-12-21/h1-8,12H,9-11H2,(H,17,19)(H,20,22)
InChIKeyQQKYXSZIXOUJFW-UHFFFAOYSA-N
XLogP1.98
TPSA69.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-anilino-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 119399959
N-(2-morpholin-4-ylphenyl)-2-[4-(trifluoromethyl)anilino]acetamide
CID 109009790
2-anilino-N-(3-methyl-4-pyridinyl)acetamide
CID 63670867
2-anilino-N-(4-pyridin-4-ylphenyl)acetamide
CID 15981382
2-anilino-N-isoquinolin-5-ylacetamide
CID 60860768
2-anilino-N-(2-chloro-3-pyridinyl)acetamide
CID 60661396
2-(methylamino)-N-[2-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]phenyl]acetamide;trihydrochloride
CID 119902893
N-(2-tert-butylphenyl)-2-(4-pyrrolidin-1-ylanilino)acetamide
CID 109008236
N-(2-bromophenyl)-2-(4-pyrrolidin-1-ylanilino)acetamide
CID 109010455
N-(2-fluorophenyl)-2-(4-pyrrolidin-1-ylanilino)acetamide
CID 109008370
2-anilino-N-naphthalen-1-ylacetamide
CID 767556
2-[2-(4,5-dihydroimidazol-1-yl)phenyl]propan-1-ol
CID 117292773

Frequently Asked Questions

What is the IUPAC name of N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide?
The IUPAC name of N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide (CID 23036184) is N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide.
What is the SMILES notation for N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide?
The canonical SMILES for N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide is O=C(CNc1ccncc1)Nc1ccccc1N1C=NCC1.
What is the InChIKey of N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide?
The InChIKey is QQKYXSZIXOUJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c22-16(11-19-13-5-7-17-8-6-13)20-14-3-1-2-4-15(14)21-10-9-18-12-21/h1-8,12H,9-11H2,(H,17,19)(H,20,22).
What are the key properties of N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide?
N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide has a molecular weight of 295.35 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,5-dihydroimidazol-1-yl)phenyl]-2-(pyridin-4-ylamino)acetamide is sourced from PubChem (CID 23036184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).