N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

About N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide (PubChem CID 119660151) has the molecular formula C20H36N4O3 and a molecular weight of 380.53 g/mol. Its IUPAC name is N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide.

Molecular Properties

Compound Name	N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
PubChem CID	119660151
Molecular Formula	C20H36N4O3
Molecular Weight	380.53 g/mol
Exact Mass	380.28
IUPAC Name	N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
SMILES	CC1CC(C)(C)CC2(C1)NC(=O)N(CC(=O)N(C)CCC(N)C(C)C)C2=O
InChI	InChI=1S/C20H36N4O3/c1-13(2)15(21)7-8-23(6)16(25)11-24-17(26)20(22-18(24)27)10-14(3)9-19(4,5)12-20/h13-15H,7-12,21H2,1-6H3,(H,22,27)
InChIKey	CMPOQLABRJZXNF-UHFFFAOYSA-N
XLogP	1.96
TPSA	95.74 Å²
H-Bond Donors	2
H-Bond Acceptors	4
Rotatable Bonds	6
Heavy Atoms	27
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	380.53
LogP ≤ 5	1.96
H-Bond Donors ≤ 5	2
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-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?

The IUPAC name of 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) is N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide.

What is the SMILES notation for N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?

The canonical SMILES for N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide is CC1CC(C)(C)CC2(C1)NC(=O)N(CC(=O)N(C)CCC(N)C(C)C)C2=O.

What is the InChIKey of N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?

The InChIKey is CMPOQLABRJZXNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36N4O3/c1-13(2)15(21)7-8-23(6)16(25)11-24-17(26)20(22-18(24)27)10-14(3)9-19(4,5)12-20/h13-15H,7-12,21H2,1-6H3,(H,22,27).

What are the key properties of N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide?

N-(3-amino-4-methylpentyl)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide has a molecular weight of 380.53 g/mol, XLogP of 1.96, 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)-N-methyl-2-(7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide is sourced from PubChem (CID 119660151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).