N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine

C17H33NO — CID 81024162

IUPACN-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine
SMILESCC(C)NCC1CCCCC1CCCC1CCCO1
InChIInChI=1S/C17H33NO/c1-14(2)18-13-16-8-4-3-7-15(16)9-5-10-17-11-6-12-19-17/h14-18H,3-13H2,1-2H3
InChIKeyGNXGMPSFSQJYOA-UHFFFAOYSA-N
MW267.46 g/mol
LogP4.14
Rot. Bonds7

About N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine

N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine (PubChem CID 81024162) has the molecular formula C17H33NO and a molecular weight of 267.46 g/mol. Its IUPAC name is N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine
PubChem CID81024162
Molecular FormulaC17H33NO
Molecular Weight267.46 g/mol
Exact Mass267.26
IUPAC NameN-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine
SMILESCC(C)NCC1CCCCC1CCCC1CCCO1
InChIInChI=1S/C17H33NO/c1-14(2)18-13-16-8-4-3-7-15(16)9-5-10-17-11-6-12-19-17/h14-18H,3-13H2,1-2H3
InChIKeyGNXGMPSFSQJYOA-UHFFFAOYSA-N
XLogP4.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-[3-(oxolan-2-yl)propyl]cyclobutyl]methyl]propan-2-amine
CID 81017533
2-methyl-N-[[2-[3-(oxolan-2-yl)propyl]cycloheptyl]methyl]propan-1-amine
CID 81033452
N-(oxolan-2-ylmethyl)propan-2-amine;hydrochloride
CID 172772952
5-(oxolan-2-yl)-N-propan-2-ylpentan-1-amine
CID 65166491
2-methyl-N-[[2-[2-(oxolan-2-yl)ethyl]cycloheptyl]methyl]propan-1-amine
CID 81025739
2-[3-(oxolan-2-yl)propyl]cycloheptan-1-amine
CID 65162768
2-[3-(oxiran-2-yl)propyl]oxolane
CID 115410470
2-[3-(oxan-2-yl)propyl]oxane
CID 71182925
N-[[1-[3-(oxolan-2-yl)propyl]piperidin-3-yl]methyl]propan-2-amine
CID 65161095
N-methyl-1-[2-[2-(oxolan-2-yl)ethyl]cyclopentyl]methanamine
CID 81034767
N-[(1R)-1-cyclohexylethyl]-3-(oxolan-2-yl)propan-1-amine
CID 81385044
2-[3-(2-chlorocyclopentyl)propyl]oxolane
CID 65166471

Frequently Asked Questions

What is the IUPAC name of N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine?
The IUPAC name of N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine (CID 81024162) is N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine.
What is the SMILES notation for N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine?
The canonical SMILES for N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine is CC(C)NCC1CCCCC1CCCC1CCCO1.
What is the InChIKey of N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine?
The InChIKey is GNXGMPSFSQJYOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO/c1-14(2)18-13-16-8-4-3-7-15(16)9-5-10-17-11-6-12-19-17/h14-18H,3-13H2,1-2H3.
What are the key properties of N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine?
N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine has a molecular weight of 267.46 g/mol, XLogP of 4.14, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[3-(oxolan-2-yl)propyl]cyclohexyl]methyl]propan-2-amine is sourced from PubChem (CID 81024162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).