N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide

C14H24N4O3 — CID 119660125

IUPACN-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
SMILESCC(C)C(N)CCN(C)C(=O)Cn1ccc(=O)n(C)c1=O
InChIInChI=1S/C14H24N4O3/c1-10(2)11(15)5-7-16(3)13(20)9-18-8-6-12(19)17(4)14(18)21/h6,8,10-11H,5,7,9,15H2,1-4H3
InChIKeyTWBIJKBGIKQQQS-UHFFFAOYSA-N
MW296.37 g/mol
LogP-0.62
Rot. Bonds6

About N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide

N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide (PubChem CID 119660125) has the molecular formula C14H24N4O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
PubChem CID119660125
Molecular FormulaC14H24N4O3
Molecular Weight296.37 g/mol
Exact Mass296.18
IUPAC NameN-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
SMILESCC(C)C(N)CCN(C)C(=O)Cn1ccc(=O)n(C)c1=O
InChIInChI=1S/C14H24N4O3/c1-10(2)11(15)5-7-16(3)13(20)9-18-8-6-12(19)17(4)14(18)21/h6,8,10-11H,5,7,9,15H2,1-4H3
InChIKeyTWBIJKBGIKQQQS-UHFFFAOYSA-N
XLogP-0.62
TPSA90.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-amino-4-methylpentyl)-2-(3-benzyl-2,6-dioxopyrimidin-1-yl)-N-methylacetamide
CID 119659586
N-(3-amino-4-methylpentyl)-2-(1,3-dioxoisoindol-2-yl)-N-methylacetamide
CID 119659914
2-[[2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetyl]-(2-methylpropyl)amino]acetic acid
CID 63072592
N-(3-amino-4-methylpentyl)-N-methyl-2-(1-oxophthalazin-2-yl)acetamide;hydrochloride
CID 119657464
N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide
CID 119661461
N-(3-amino-4-methylpentyl)-N-methylpropanamide
CID 81484424
(2S)-3-methyl-2-[[2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetyl]amino]butanoic acid
CID 61137273
2-(3-methyl-2,4-dioxopyrimidin-1-yl)-N-(3-methyl-2-propan-2-ylbutyl)acetamide
CID 102914909
N-(3-amino-4-methylpentyl)-2-(3,5-dimethylpyrazol-1-yl)-N-methylacetamide
CID 81484328
N-(3-amino-4-methylpentyl)-N-methyl-1-propylpyrrole-2-carboxamide
CID 115317425
4-amino-N-(3-amino-4-methylpentyl)-N-methylbenzamide
CID 122080936
N-(3-amino-4-methylpentyl)-2-(4-chlorophenyl)-N-methylacetamide
CID 81484430

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The IUPAC name of N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide (CID 119660125) is N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide is CC(C)C(N)CCN(C)C(=O)Cn1ccc(=O)n(C)c1=O.
What is the InChIKey of N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
The InChIKey is TWBIJKBGIKQQQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O3/c1-10(2)11(15)5-7-16(3)13(20)9-18-8-6-12(19)17(4)14(18)21/h6,8,10-11H,5,7,9,15H2,1-4H3.
What are the key properties of N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide?
N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide has a molecular weight of 296.37 g/mol, XLogP of -0.62, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 119660125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).