N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide

C22H25N5O — CID 112881584

IUPACN-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide
SMILESCCN(CC)c1cc(Nc2ccc(NC(C)=O)cc2)nc(-c2ccccc2)n1
InChIInChI=1S/C22H25N5O/c1-4-27(5-2)21-15-20(25-22(26-21)17-9-7-6-8-10-17)24-19-13-11-18(12-14-19)23-16(3)28/h6-15H,4-5H2,1-3H3,(H,23,28)(H,24,25,26)
InChIKeySDPJTWNWFLITBC-UHFFFAOYSA-N
MW375.48 g/mol
LogP4.69
Rot. Bonds7

About N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide

N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide (PubChem CID 112881584) has the molecular formula C22H25N5O and a molecular weight of 375.48 g/mol. Its IUPAC name is N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide
PubChem CID112881584
Molecular FormulaC22H25N5O
Molecular Weight375.48 g/mol
Exact Mass375.21
IUPAC NameN-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide
SMILESCCN(CC)c1cc(Nc2ccc(NC(C)=O)cc2)nc(-c2ccccc2)n1
InChIInChI=1S/C22H25N5O/c1-4-27(5-2)21-15-20(25-22(26-21)17-9-7-6-8-10-17)24-19-13-11-18(12-14-19)23-16(3)28/h6-15H,4-5H2,1-3H3,(H,23,28)(H,24,25,26)
InChIKeySDPJTWNWFLITBC-UHFFFAOYSA-N
XLogP4.69
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.48
LogP ≤ 54.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-[4-(dimethylamino)phenyl]-4-N,4-N-diethyl-2-phenylpyrimidine-4,6-diamine
CID 112881588
1-[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-3-phenylurea
CID 122296681
N-[4-[[6-(2-methoxyethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide
CID 112880342
4-N,4-N-diethyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879230
6-(4-acetylanilino)-N,N-diethyl-2-phenylpyrimidine-4-carboxamide
CID 112854257
4-N,4-N-diethyl-6-N-(2-methylpropyl)-2-phenylpyrimidine-4,6-diamine
CID 112879814
N-[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-2-phenoxypropanamide
CID 122296624
N,N-diethyl-2,6-diphenylpyrimidin-4-amine
CID 2057498
N-[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]-3,5-dimethylbenzamide
CID 122296625
N-[4-[[4-(diethylamino)-6-methylpyrimidin-2-yl]amino]phenyl]-4-phenylbenzamide
CID 18566738
3-bromo-N-[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]benzamide
CID 122296946
6-chloro-N,N-diethyl-2-phenylpyrimidin-4-amine
CID 796090

Frequently Asked Questions

What is the IUPAC name of N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide?
The IUPAC name of N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide (CID 112881584) is N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide.
What is the SMILES notation for N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide?
The canonical SMILES for N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide is CCN(CC)c1cc(Nc2ccc(NC(C)=O)cc2)nc(-c2ccccc2)n1.
What is the InChIKey of N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide?
The InChIKey is SDPJTWNWFLITBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N5O/c1-4-27(5-2)21-15-20(25-22(26-21)17-9-7-6-8-10-17)24-19-13-11-18(12-14-19)23-16(3)28/h6-15H,4-5H2,1-3H3,(H,23,28)(H,24,25,26).
What are the key properties of N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide?
N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide has a molecular weight of 375.48 g/mol, XLogP of 4.69, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[6-(diethylamino)-2-phenylpyrimidin-4-yl]amino]phenyl]acetamide is sourced from PubChem (CID 112881584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).