4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one

C15H25N3O — CID 79967350

IUPAC4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
SMILESCC(C)C1CCC2(CC1)C(N)=NC(=O)N2CC1CC1
InChIInChI=1S/C15H25N3O/c1-10(2)12-5-7-15(8-6-12)13(16)17-14(19)18(15)9-11-3-4-11/h10-12H,3-9H2,1-2H3,(H2,16,17,19)
InChIKeyXWUSWDDGQUDGJZ-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.77
Rot. Bonds3

About 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one

4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one (PubChem CID 79967350) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one.

Molecular Properties

Compound Name4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
PubChem CID79967350
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one
SMILESCC(C)C1CCC2(CC1)C(N)=NC(=O)N2CC1CC1
InChIInChI=1S/C15H25N3O/c1-10(2)12-5-7-15(8-6-12)13(16)17-14(19)18(15)9-11-3-4-11/h10-12H,3-9H2,1-2H3,(H2,16,17,19)
InChIKeyXWUSWDDGQUDGJZ-UHFFFAOYSA-N
XLogP2.77
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The IUPAC name of 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one (CID 79967350) is 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one.
What is the SMILES notation for 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The canonical SMILES for 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one is CC(C)C1CCC2(CC1)C(N)=NC(=O)N2CC1CC1.
What is the InChIKey of 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
The InChIKey is XWUSWDDGQUDGJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-10(2)12-5-7-15(8-6-12)13(16)17-14(19)18(15)9-11-3-4-11/h10-12H,3-9H2,1-2H3,(H2,16,17,19).
What are the key properties of 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one?
4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one has a molecular weight of 263.38 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(cyclopropylmethyl)-8-propan-2-yl-1,3-diazaspiro[4.5]dec-3-en-2-one is sourced from PubChem (CID 79967350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).