N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine

C14H25N3 — CID 142371605

IUPACN-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine
SMILESC=NC(=C)N1CCC2(CC1)CCN(C(C)C)C2
InChIInChI=1S/C14H25N3/c1-12(2)17-10-7-14(11-17)5-8-16(9-6-14)13(3)15-4/h12H,3-11H2,1-2H3
InChIKeyLNSBFHKRCPSDHB-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.35
Rot. Bonds3

About N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine

N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine (PubChem CID 142371605) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine.

Molecular Properties

Compound NameN-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine
PubChem CID142371605
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine
SMILESC=NC(=C)N1CCC2(CC1)CCN(C(C)C)C2
InChIInChI=1S/C14H25N3/c1-12(2)17-10-7-14(11-17)5-8-16(9-6-14)13(3)15-4/h12H,3-11H2,1-2H3
InChIKeyLNSBFHKRCPSDHB-UHFFFAOYSA-N
XLogP2.35
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-methyl-N-[[1-[1-(methylideneamino)ethenyl]piperidin-4-yl]methyl]propan-2-amine
CID 156711934

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine?
The IUPAC name of N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine (CID 142371605) is N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine.
What is the SMILES notation for N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine?
The canonical SMILES for N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine is C=NC(=C)N1CCC2(CC1)CCN(C(C)C)C2.
What is the InChIKey of N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine?
The InChIKey is LNSBFHKRCPSDHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-12(2)17-10-7-14(11-17)5-8-16(9-6-14)13(3)15-4/h12H,3-11H2,1-2H3.
What are the key properties of N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine?
N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine has a molecular weight of 235.37 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethenyl]methanimine is sourced from PubChem (CID 142371605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).