N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine

C12H23NO2 — CID 165438987

IUPACN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine
SMILESCC1(CCNC2CCCCC2)OCCO1
InChIInChI=1S/C12H23NO2/c1-12(14-9-10-15-12)7-8-13-11-5-3-2-4-6-11/h11,13H,2-10H2,1H3
InChIKeyRBSLVJDIFRHZBS-UHFFFAOYSA-N
MW213.32 g/mol
LogP2.06
Rot. Bonds4

About N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine

N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine (PubChem CID 165438987) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine.

Molecular Properties

Compound NameN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine
PubChem CID165438987
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine
SMILESCC1(CCNC2CCCCC2)OCCO1
InChIInChI=1S/C12H23NO2/c1-12(14-9-10-15-12)7-8-13-11-5-3-2-4-6-11/h11,13H,2-10H2,1H3
InChIKeyRBSLVJDIFRHZBS-UHFFFAOYSA-N
XLogP2.06
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-methyl-1,3-dioxolan-2-yl)methyl]cyclohexanamine
CID 131153771
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethylsulfamoyl]cyclopentanamine
CID 110611947
1-[2-(cyclohexylamino)ethyl]-N-methylcyclohexan-1-amine
CID 65241332
1-[2-(cyclopentylamino)ethyl]-N-methylcyclohexan-1-amine
CID 65241436
1-cyclobutyl-N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]propan-2-amine
CID 104628570
N-propylcyclohexanamine;hydrochloride
CID 17370003
azane;N-propylcyclohexanamine
CID 19368218
N'-cyclohexyl-N-[2-(cyclohexylamino)ethyl]ethane-1,2-diamine
CID 23423562
N'-cycloundecylethane-1,2-diamine
CID 166845791
N-[2-[1-(aminomethyl)cyclohexyl]ethyl]cycloheptanamine
CID 113440233
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]oxolane-2-carboxamide
CID 110423404
N-[(2-methyl-1,3-dioxolan-2-yl)methyl]-1,1-dioxothian-4-amine
CID 131065113

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine?
The IUPAC name of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine (CID 165438987) is N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine.
What is the SMILES notation for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine?
The canonical SMILES for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine is CC1(CCNC2CCCCC2)OCCO1.
What is the InChIKey of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine?
The InChIKey is RBSLVJDIFRHZBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-12(14-9-10-15-12)7-8-13-11-5-3-2-4-6-11/h11,13H,2-10H2,1H3.
What are the key properties of N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine?
N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine has a molecular weight of 213.32 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclohexanamine is sourced from PubChem (CID 165438987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).