N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride

About N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride

N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride (PubChem CID 119383121) has the molecular formula C17H31ClN4O3 and a molecular weight of 374.91 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride.

Molecular Properties

Compound Name	N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride
PubChem CID	119383121
Molecular Formula	C17H31ClN4O3
Molecular Weight	374.91 g/mol
Exact Mass	374.21
IUPAC Name	N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride
SMILES	CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NCCN)C2=O.Cl
InChI	InChI=1S/C17H30N4O3.ClH/c1-4-16(2,3)12-5-7-17(8-6-12)14(23)21(15(24)20-17)11-13(22)19-10-9-18;/h12H,4-11,18H2,1-3H3,(H,19,22)(H,20,24);1H
InChIKey	GACUEVMCMHZENV-UHFFFAOYSA-N
XLogP	1.40
TPSA	104.53 Å²
H-Bond Donors	3
H-Bond Acceptors	4
Rotatable Bonds	6
Heavy Atoms	25
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	374.91
LogP ≤ 5	1.40
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride?

The IUPAC name of N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride (CID 119383121) is N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride.

What is the SMILES notation for N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride?

The canonical SMILES for N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride is CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NCCN)C2=O.Cl.

What is the InChIKey of N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride?

The InChIKey is GACUEVMCMHZENV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O3.ClH/c1-4-16(2,3)12-5-7-17(8-6-12)14(23)21(15(24)20-17)11-13(22)19-10-9-18;/h12H,4-11,18H2,1-3H3,(H,19,22)(H,20,24);1H.

What are the key properties of N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride?

N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride has a molecular weight of 374.91 g/mol, XLogP of 1.40, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-aminoethyl)-2-[8-(2-methylbutan-2-yl)-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide;hydrochloride is sourced from PubChem (CID 119383121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).