3-cyclohexylpropan-1-amine;ethane

C11H25N — CID 143945055

IUPAC3-cyclohexylpropan-1-amine;ethane
SMILESCC.NCCCC1CCCCC1
InChIInChI=1S/C9H19N.C2H6/c10-8-4-7-9-5-2-1-3-6-9;1-2/h9H,1-8,10H2;1-2H3
InChIKeyKDORQPFTJMUZEV-UHFFFAOYSA-N
MW171.33 g/mol
LogP3.33
Rot. Bonds3

About 3-cyclohexylpropan-1-amine;ethane

3-cyclohexylpropan-1-amine;ethane (PubChem CID 143945055) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is 3-cyclohexylpropan-1-amine;ethane.

Molecular Properties

Compound Name3-cyclohexylpropan-1-amine;ethane
PubChem CID143945055
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC Name3-cyclohexylpropan-1-amine;ethane
SMILESCC.NCCCC1CCCCC1
InChIInChI=1S/C9H19N.C2H6/c10-8-4-7-9-5-2-1-3-6-9;1-2/h9H,1-8,10H2;1-2H3
InChIKeyKDORQPFTJMUZEV-UHFFFAOYSA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 67665513
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3-cyclohexadecylpropylcyclohexadecane
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4-cyclopentylbutylcyclohexane
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3-cyclobutylpropylcyclohexane
CID 54165208
4-(3-aminopropyl)cyclohexan-1-amine
CID 22292235
N'-(4-cyclopentadecylbutyl)ethane-1,2-diamine
CID 159351931
N'-[2-(3-cyclodecylpropylamino)ethyl]ethane-1,2-diamine
CID 126513357
3-[2-(3-aminopropyl)cyclohexyl]propan-1-amine
CID 67095749
4-cyclohexylbutane-1,1-diamine
CID 174921978
tetradecylcycloundecane
CID 169026040

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexylpropan-1-amine;ethane?
The IUPAC name of 3-cyclohexylpropan-1-amine;ethane (CID 143945055) is 3-cyclohexylpropan-1-amine;ethane.
What is the SMILES notation for 3-cyclohexylpropan-1-amine;ethane?
The canonical SMILES for 3-cyclohexylpropan-1-amine;ethane is CC.NCCCC1CCCCC1.
What is the InChIKey of 3-cyclohexylpropan-1-amine;ethane?
The InChIKey is KDORQPFTJMUZEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.C2H6/c10-8-4-7-9-5-2-1-3-6-9;1-2/h9H,1-8,10H2;1-2H3.
What are the key properties of 3-cyclohexylpropan-1-amine;ethane?
3-cyclohexylpropan-1-amine;ethane has a molecular weight of 171.33 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexylpropan-1-amine;ethane is sourced from PubChem (CID 143945055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).