2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide

C16H20N4O — CID 60854044

IUPAC2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide
SMILESCCCCC(N)C(=O)Nc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C16H20N4O/c1-2-3-9-14(17)16(21)20-13-10-18-15(19-11-13)12-7-5-4-6-8-12/h4-8,10-11,14H,2-3,9,17H2,1H3,(H,20,21)
InChIKeyHMYPGRLTQDUTLW-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.60
Rot. Bonds6

About 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide

2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide (PubChem CID 60854044) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide.

Molecular Properties

Compound Name2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide
PubChem CID60854044
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide
SMILESCCCCC(N)C(=O)Nc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C16H20N4O/c1-2-3-9-14(17)16(21)20-13-10-18-15(19-11-13)12-7-5-4-6-8-12/h4-8,10-11,14H,2-3,9,17H2,1H3,(H,20,21)
InChIKeyHMYPGRLTQDUTLW-UHFFFAOYSA-N
XLogP2.60
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(2-phenylpyrimidin-5-yl)pentanamide
CID 43709270
2-amino-3-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide
CID 43709265
3-(ethylamino)-2-methyl-N-(2-phenylpyrimidin-5-yl)propanamide
CID 62851834
(2S)-2-amino-N-(2-phenylphenyl)hexanamide
CID 103830910
N-(2-phenylpyrimidin-5-yl)propanamide
CID 53014772
5-(2-aminohexanoylamino)benzene-1,3-dicarboxylic acid
CID 61160490
N-(3-acetamidophenyl)-2-aminohexanamide
CID 60852572
(2S)-2-amino-1-phenylhexan-1-one
CID 139626010
2-amino-N-(4-bromophenyl)hexanamide
CID 60852203
2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 60926904
2-[(2-phenylpyrimidin-5-yl)methylamino]hexanoic acid
CID 91671248
2-amino-2-methyl-N-(2-phenylpyrimidin-5-yl)pentanamide
CID 60848234

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide?
The IUPAC name of 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide (CID 60854044) is 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide.
What is the SMILES notation for 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide?
The canonical SMILES for 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide is CCCCC(N)C(=O)Nc1cnc(-c2ccccc2)nc1.
What is the InChIKey of 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide?
The InChIKey is HMYPGRLTQDUTLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-3-9-14(17)16(21)20-13-10-18-15(19-11-13)12-7-5-4-6-8-12/h4-8,10-11,14H,2-3,9,17H2,1H3,(H,20,21).
What are the key properties of 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide?
2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide has a molecular weight of 284.36 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide is sourced from PubChem (CID 60854044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).