2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine

C13H25NO2 — CID 159679280

IUPAC2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine
SMILESCC(C)NC1(C2CCCCC2)COCCO1
InChIInChI=1S/C13H25NO2/c1-11(2)14-13(10-15-8-9-16-13)12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3
InChIKeyMUZXRKWOYIRBPN-UHFFFAOYSA-N
MW227.35 g/mol
LogP2.31
Rot. Bonds3

About 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine

2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine (PubChem CID 159679280) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine.

Molecular Properties

Compound Name2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine
PubChem CID159679280
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine
SMILESCC(C)NC1(C2CCCCC2)COCCO1
InChIInChI=1S/C13H25NO2/c1-11(2)14-13(10-15-8-9-16-13)12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3
InChIKeyMUZXRKWOYIRBPN-UHFFFAOYSA-N
XLogP2.31
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,4-Dioxaspiro(5.5)undecane-3-methanamine, 5-methyl-N-(1-methylethyl)-, hydrochloride
CID 13370194
3-Cyclohexylmorpholine hydrochloride
CID 154832834
3-Cyclohexylmorpholine
CID 54373245
N-[(5-methyl-1,4-dioxaspiro[5.5]undecan-3-yl)methyl]propan-2-amine
CID 13370193
2-(3,3-difluorocyclohexyl)-1-(1,4-dioxan-2-yl)-N-methylethanamine
CID 114225829
(3S)-3-[cyclohexyl(methoxy)methyl]morpholine
CID 20648539
N-methyl-2-morpholin-2-ylcyclohexan-1-amine
CID 23192810
(S)-3-Cyclohexylmorpholine
CID 55294709
N-(1-cyclohexyl-2-propan-2-yloxyethyl)propan-2-amine
CID 58384613
trans-(1R,2R)-N-methyl-2-morpholin-2-ylcyclohexan-1-amine
CID 67785088
(R)-3-Cyclohexylmorpholine
CID 71607315
2-Cyclohexyl-3-methylmorpholine
CID 82601830

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine?
The IUPAC name of 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine (CID 159679280) is 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine.
What is the SMILES notation for 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine?
The canonical SMILES for 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine is CC(C)NC1(C2CCCCC2)COCCO1.
What is the InChIKey of 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine?
The InChIKey is MUZXRKWOYIRBPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-11(2)14-13(10-15-8-9-16-13)12-6-4-3-5-7-12/h11-12,14H,3-10H2,1-2H3.
What are the key properties of 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine?
2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine has a molecular weight of 227.35 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-propan-2-yl-1,4-dioxan-2-amine is sourced from PubChem (CID 159679280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).