2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide

C14H20N4O — CID 82245947

IUPAC2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide
SMILESCN(C)CC(=O)Nc1ccc(C2=NCCCN2)cc1
InChIInChI=1S/C14H20N4O/c1-18(2)10-13(19)17-12-6-4-11(5-7-12)14-15-8-3-9-16-14/h4-7H,3,8-10H2,1-2H3,(H,15,16)(H,17,19)
InChIKeyZAHLADYJZKRFPN-UHFFFAOYSA-N
MW260.34 g/mol
LogP0.93
Rot. Bonds4

About 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide

2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide (PubChem CID 82245947) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide
PubChem CID82245947
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide
SMILESCN(C)CC(=O)Nc1ccc(C2=NCCCN2)cc1
InChIInChI=1S/C14H20N4O/c1-18(2)10-13(19)17-12-6-4-11(5-7-12)14-15-8-3-9-16-14/h4-7H,3,8-10H2,1-2H3,(H,15,16)(H,17,19)
InChIKeyZAHLADYJZKRFPN-UHFFFAOYSA-N
XLogP0.93
TPSA56.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[4-(dimethylamino)phenyl]-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]propanamide
CID 82252916
4-methyl-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzamide
CID 82251166
N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]butanamide
CID 82242863
1-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]-3-[7-[[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]carbamoylamino]heptyl]urea;hydrochloride
CID 54609528
2-[4-(dimethylsulfamoylamino)phenyl]-1,4,5,6-tetrahydropyrimidine
CID 82249387
1-[3-amino-5-[[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]carbamoylamino]phenyl]-3-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]urea
CID 168914194
ethyl 3-[4-(4,5-dihydro-1H-imidazol-2-yl)anilino]-3-oxopropanoate
CID 110465453
1-[3-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]-3-[4-[[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]carbamoylamino]phenyl]urea;hydrochloride
CID 54612096
3-acetamido-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzamide
CID 82240480
2-(dimethylamino)-N-[4-(dimethylamino)phenyl]acetamide
CID 18870888
2-amino-N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-methylpropanamide
CID 110460893
4-methyl-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]benzenesulfonamide
CID 82240327

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide?
The IUPAC name of 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide (CID 82245947) is 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide is CN(C)CC(=O)Nc1ccc(C2=NCCCN2)cc1.
What is the InChIKey of 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide?
The InChIKey is ZAHLADYJZKRFPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-18(2)10-13(19)17-12-6-4-11(5-7-12)14-15-8-3-9-16-14/h4-7H,3,8-10H2,1-2H3,(H,15,16)(H,17,19).
What are the key properties of 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide?
2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide has a molecular weight of 260.34 g/mol, XLogP of 0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[4-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]acetamide is sourced from PubChem (CID 82245947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).