N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide

C14H25N3O4 — CID 61039174

IUPACN-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide
SMILESCC(C)N(CCCO)C(=O)CCCN1C(=O)CN(C)C1=O
InChIInChI=1S/C14H25N3O4/c1-11(2)16(8-5-9-18)12(19)6-4-7-17-13(20)10-15(3)14(17)21/h11,18H,4-10H2,1-3H3
InChIKeyPAZYVCFOAYZSAH-UHFFFAOYSA-N
MW299.37 g/mol
LogP0.28
Rot. Bonds8

About N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide

N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide (PubChem CID 61039174) has the molecular formula C14H25N3O4 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide.

Molecular Properties

Compound NameN-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide
PubChem CID61039174
Molecular FormulaC14H25N3O4
Molecular Weight299.37 g/mol
Exact Mass299.18
IUPAC NameN-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide
SMILESCC(C)N(CCCO)C(=O)CCCN1C(=O)CN(C)C1=O
InChIInChI=1S/C14H25N3O4/c1-11(2)16(8-5-9-18)12(19)6-4-7-17-13(20)10-15(3)14(17)21/h11,18H,4-10H2,1-3H3
InChIKeyPAZYVCFOAYZSAH-UHFFFAOYSA-N
XLogP0.28
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[[2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetyl]-propan-2-ylamino]butanoic acid
CID 60826752
N-(2-hydroxyethyl)-N-(2-methoxyethyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 115772430
N-(3-hydroxypropyl)-N-propan-2-ylpentanamide
CID 61039653
N-(3-hydroxy-2-methylpropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 65032246
1-methyl-3-(4-oxohexyl)imidazolidine-2,4-dione
CID 106801687
3-[4-(3,4-dihydroxypyrrolidin-1-yl)-4-oxobutyl]-1-methylimidazolidine-2,4-dione
CID 106671587
N-(1-hydroxypentan-3-yl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 115735166
3-[4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanoylamino]butanoic acid
CID 43360769
3-(tert-butylamino)-N-(3-hydroxypropyl)-N-propan-2-ylpropanamide
CID 54916197
4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(2-methylpropan-2-yl)oxy]butanamide
CID 82725201
N-cyano-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 79194682
N-[4-[ethyl(propan-2-yl)amino]phenyl]-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 78807951

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide?
The IUPAC name of N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide (CID 61039174) is N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide.
What is the SMILES notation for N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide?
The canonical SMILES for N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide is CC(C)N(CCCO)C(=O)CCCN1C(=O)CN(C)C1=O.
What is the InChIKey of N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide?
The InChIKey is PAZYVCFOAYZSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4/c1-11(2)16(8-5-9-18)12(19)6-4-7-17-13(20)10-15(3)14(17)21/h11,18H,4-10H2,1-3H3.
What are the key properties of N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide?
N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide has a molecular weight of 299.37 g/mol, XLogP of 0.28, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypropyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-propan-2-ylbutanamide is sourced from PubChem (CID 61039174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).