N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide

C14H26N4O3 — CID 119661461

IUPACN-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide
SMILESCC(C)C(N)CCN(C)C(=O)CN1C(=O)NC(=O)C1(C)C
InChIInChI=1S/C14H26N4O3/c1-9(2)10(15)6-7-17(5)11(19)8-18-13(21)16-12(20)14(18,3)4/h9-10H,6-8,15H2,1-5H3,(H,16,20,21)
InChIKeyGQJDLPFIZKVMBD-UHFFFAOYSA-N
MW298.39 g/mol
LogP0.15
Rot. Bonds6

About N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide

N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide (PubChem CID 119661461) has the molecular formula C14H26N4O3 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide
PubChem CID119661461
Molecular FormulaC14H26N4O3
Molecular Weight298.39 g/mol
Exact Mass298.20
IUPAC NameN-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide
SMILESCC(C)C(N)CCN(C)C(=O)CN1C(=O)NC(=O)C1(C)C
InChIInChI=1S/C14H26N4O3/c1-9(2)10(15)6-7-17(5)11(19)8-18-13(21)16-12(20)14(18,3)4/h9-10H,6-8,15H2,1-5H3,(H,16,20,21)
InChIKeyGQJDLPFIZKVMBD-UHFFFAOYSA-N
XLogP0.15
TPSA95.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

N-(3-amino-4-methylpentyl)-2-(1,3-dioxoisoindol-2-yl)-N-methylacetamide
CID 119659914
N-(3-amino-4-methylpentyl)-N-methylpropanamide
CID 81484424
2-[2-[(3-amino-4-methylpentyl)-methylamino]-2-oxoethyl]sulfanylacetamide
CID 119660546
N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 119660151
N-(3-amino-4-methylpentyl)-N-methyl-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
CID 119660125
N-(3-amino-4-methylpentyl)-2-(3,5-dimethylpyrazol-1-yl)-N-methylacetamide
CID 81484328
N-(3-amino-4-methylpentyl)-N-methyl-2-(4-nitropyrazol-1-yl)acetamide
CID 119658585
N-(3-amino-4-methylpentyl)-2-(diethylamino)-N-methylacetamide;dihydrochloride
CID 119657669
N-(3-amino-4-methylpentyl)-N-methylpentanamide;hydrochloride
CID 119657793
N-(3-amino-4-methylpentyl)-N-methyl-2-propan-2-yloxyacetamide;hydrochloride
CID 119660231
N-(3-amino-4-methylpentyl)-3-methoxy-N-methylpropanamide
CID 81485025
N-(3-amino-4-methylpentyl)-4-fluoro-N-methylbenzamide
CID 81484690

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide?
The IUPAC name of N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide (CID 119661461) is N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide.
What is the SMILES notation for N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide?
The canonical SMILES for N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide is CC(C)C(N)CCN(C)C(=O)CN1C(=O)NC(=O)C1(C)C.
What is the InChIKey of N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide?
The InChIKey is GQJDLPFIZKVMBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O3/c1-9(2)10(15)6-7-17(5)11(19)8-18-13(21)16-12(20)14(18,3)4/h9-10H,6-8,15H2,1-5H3,(H,16,20,21).
What are the key properties of N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide?
N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide has a molecular weight of 298.39 g/mol, XLogP of 0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylpentyl)-2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)-N-methylacetamide is sourced from PubChem (CID 119661461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).