N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine

C15H27NO2 — CID 43194980

IUPACN-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine
SMILESCC1CCCCC1NC1CCC2(CC1)OCCO2
InChIInChI=1S/C15H27NO2/c1-12-4-2-3-5-14(12)16-13-6-8-15(9-7-13)17-10-11-18-15/h12-14,16H,2-11H2,1H3
InChIKeyVGQHIOHFUSKBSE-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.84
Rot. Bonds2

About N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine

N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine (PubChem CID 43194980) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine.

Molecular Properties

Compound NameN-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine
PubChem CID43194980
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC NameN-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine
SMILESCC1CCCCC1NC1CCC2(CC1)OCCO2
InChIInChI=1S/C15H27NO2/c1-12-4-2-3-5-14(12)16-13-6-8-15(9-7-13)17-10-11-18-15/h12-14,16H,2-11H2,1H3
InChIKeyVGQHIOHFUSKBSE-UHFFFAOYSA-N
XLogP2.84
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-methylthiolan-3-yl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 130847982
cis-(1R,2S)-N-cyclopropyl-2-methylcyclohexan-1-amine
CID 30048017
4,4-dimethyl-N-(2-methylcyclohexyl)cycloheptan-1-amine
CID 65082506
N-(4-methylcycloheptyl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 102795154
N-(3-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 43317686
N-(5-methyl-2-propan-2-ylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 43710247
cis-(1S,2R)-2-methyl-N-[(1S,2R)-2-methylcyclopentyl]cyclohexan-1-amine
CID 124708997
2-methyl-N-(3-methylcyclobutyl)cycloheptan-1-amine
CID 104859847
N-[(1S)-1-cyclohexylethyl]-1,4-dioxaspiro[4.5]decan-8-amine
CID 81387414
N-(2,2-dimethyloxan-4-yl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 83033541
N-[(1R)-1-cycloheptylethyl]-1,4-dioxaspiro[4.5]decan-8-amine
CID 81390369
3,4-dimethyl-N-(2-methylcyclohexyl)cyclohexan-1-amine
CID 64731982

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The IUPAC name of N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine (CID 43194980) is N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine.
What is the SMILES notation for N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The canonical SMILES for N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine is CC1CCCCC1NC1CCC2(CC1)OCCO2.
What is the InChIKey of N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The InChIKey is VGQHIOHFUSKBSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-12-4-2-3-5-14(12)16-13-6-8-15(9-7-13)17-10-11-18-15/h12-14,16H,2-11H2,1H3.
What are the key properties of N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine?
N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine has a molecular weight of 253.39 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexyl)-1,4-dioxaspiro[4.5]decan-8-amine is sourced from PubChem (CID 43194980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).