2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide

C19H22N4O — CID 69492342

IUPAC2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide
SMILESCC1=NCCCN1c1ccc(NC(=O)C(N)c2ccccc2)cc1
InChIInChI=1S/C19H22N4O/c1-14-21-12-5-13-23(14)17-10-8-16(9-11-17)22-19(24)18(20)15-6-3-2-4-7-15/h2-4,6-11,18H,5,12-13,20H2,1H3,(H,22,24)
InChIKeyYNTZXDXEPCJGKQ-UHFFFAOYSA-N
MW322.41 g/mol
LogP2.95
Rot. Bonds4

About 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide

2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide (PubChem CID 69492342) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide
PubChem CID69492342
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC Name2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide
SMILESCC1=NCCCN1c1ccc(NC(=O)C(N)c2ccccc2)cc1
InChIInChI=1S/C19H22N4O/c1-14-21-12-5-13-23(14)17-10-8-16(9-11-17)22-19(24)18(20)15-6-3-2-4-7-15/h2-4,6-11,18H,5,12-13,20H2,1H3,(H,22,24)
InChIKeyYNTZXDXEPCJGKQ-UHFFFAOYSA-N
XLogP2.95
TPSA70.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[4-(3-oxomorpholin-4-yl)phenyl]-2-phenylacetamide
CID 69444352
2-amino-2-(4-methylphenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide;hydrochloride
CID 120666734
2-amino-N-(4-chlorophenyl)-2-phenylacetamide
CID 24702199
(2R)-N-(4-acetylphenyl)-2-amino-2-phenylacetamide
CID 61259858
2-amino-N-[4-[[2-(azocan-1-yl)acetyl]amino]phenyl]-2-phenylacetamide
CID 119871125
2-amino-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]-2-phenylacetamide
CID 119844839
2-amino-2-phenyl-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]acetamide
CID 119264312
2-methyl-1-(4-methylphenyl)-5,6-dihydro-4H-pyrimidine
CID 58717201
4-[[(2S)-2-amino-2-phenylacetyl]amino]-2-methylbenzoic acid
CID 103869544
4-[[(2S)-2-amino-2-phenylacetyl]amino]benzamide
CID 22691729
2-amino-N-(3,5-dimethylphenyl)-2-phenylacetamide
CID 24701080
(2R)-2-amino-N-(4-methylsulfonylphenyl)-2-phenylacetamide
CID 61148899

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide?
The IUPAC name of 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide (CID 69492342) is 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide is CC1=NCCCN1c1ccc(NC(=O)C(N)c2ccccc2)cc1.
What is the InChIKey of 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide?
The InChIKey is YNTZXDXEPCJGKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-14-21-12-5-13-23(14)17-10-8-16(9-11-17)22-19(24)18(20)15-6-3-2-4-7-15/h2-4,6-11,18H,5,12-13,20H2,1H3,(H,22,24).
What are the key properties of 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide?
2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide has a molecular weight of 322.41 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[4-(2-methyl-5,6-dihydro-4H-pyrimidin-1-yl)phenyl]-2-phenylacetamide is sourced from PubChem (CID 69492342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).