2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide

C19H30N4O3 — CID 56915461

IUPAC2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
SMILESCN(CC1(N2CCCCC2)CCCCC1)C(=O)Cc1c[nH]c(=O)[nH]c1=O
InChIInChI=1S/C19H30N4O3/c1-22(16(24)12-15-13-20-18(26)21-17(15)25)14-19(8-4-2-5-9-19)23-10-6-3-7-11-23/h13H,2-12,14H2,1H3,(H2,20,21,25,26)
InChIKeyASOXIXAISKDPMJ-UHFFFAOYSA-N
MW362.47 g/mol
LogP1.25
Rot. Bonds5

About 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide

2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide (PubChem CID 56915461) has the molecular formula C19H30N4O3 and a molecular weight of 362.47 g/mol. Its IUPAC name is 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
PubChem CID56915461
Molecular FormulaC19H30N4O3
Molecular Weight362.47 g/mol
Exact Mass362.23
IUPAC Name2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
SMILESCN(CC1(N2CCCCC2)CCCCC1)C(=O)Cc1c[nH]c(=O)[nH]c1=O
InChIInChI=1S/C19H30N4O3/c1-22(16(24)12-15-13-20-18(26)21-17(15)25)14-19(8-4-2-5-9-19)23-10-6-3-7-11-23/h13H,2-12,14H2,1H3,(H2,20,21,25,26)
InChIKeyASOXIXAISKDPMJ-UHFFFAOYSA-N
XLogP1.25
TPSA89.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide with MolForge

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Related Compounds

5-[2-(1'-methyl-4,4'-bipiperidin-1-yl)-2-oxoethyl]-2,4(1H,3H)-pyrimidinedione
CID 72875435
1-[4-[4-(Cyclohexylmethyl)piperazin-1-yl]butyl]-5-methylpyrimidine-2,4-dione
CID 66737088
1-[4-[4-(2-Cyclohexylethyl)piperazin-1-yl]butyl]-5-methylpyrimidine-2,4-dione
CID 66737894
5-[2-(3-azaspiro[5.5]undec-9-ylamino)ethyl]pyrimidine-2,4(1H,3H)-dione
CID 56704870
5-[2-(3,7-dimethyl-3,7,11-triazaspiro[5.6]dodec-11-yl)-2-oxoethyl]pyrimidine-2,4(1H,3H)-dione
CID 56742503
3-methyl-5-[2-(7-methyl-12-oxo-3,7,11-triazaspiro[5.6]dodecan-3-yl)-2-oxoethyl]-1H-pyrimidine-2,4-dione
CID 56753580
N-[1-(cyclohexylmethyl)-3-piperidinyl]-2-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)acetamide
CID 56892643
N-[1-(cyclohexylmethyl)-3-piperidinyl]-2-(2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)acetamide
CID 56893684
N-methyl-2,4-dioxo-N-{[1-(1-piperidinyl)cyclohexyl]methyl}-1,2,3,4-tetrahydro-5-pyrimidinecarboxamide
CID 56896504
5-{2-[4-(1-adamantyl)-1-piperazinyl]-2-oxoethyl}-2,4(1H,3H)-pyrimidinedione
CID 56900051
N-methyl-2-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)-N-{[1-(1-piperidinyl)cyclohexyl]methyl}acetamide
CID 56904431
5-(1,4-diazaspiro[5.5]undecane-1-carbonyl)-1H-pyrimidine-2,4-dione
CID 65528768

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
The IUPAC name of 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide (CID 56915461) is 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide.
What is the SMILES notation for 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
The canonical SMILES for 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide is CN(CC1(N2CCCCC2)CCCCC1)C(=O)Cc1c[nH]c(=O)[nH]c1=O.
What is the InChIKey of 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
The InChIKey is ASOXIXAISKDPMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O3/c1-22(16(24)12-15-13-20-18(26)21-17(15)25)14-19(8-4-2-5-9-19)23-10-6-3-7-11-23/h13H,2-12,14H2,1H3,(H2,20,21,25,26).
What are the key properties of 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide has a molecular weight of 362.47 g/mol, XLogP of 1.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dioxo-1H-pyrimidin-5-yl)-N-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide is sourced from PubChem (CID 56915461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).