2-cyclohexylpropan-1-amine;hydrochloride

C9H20ClN — CID 24837056

IUPAC2-cyclohexylpropan-1-amine;hydrochloride
SMILESCC(CN)C1CCCCC1.Cl
InChIInChI=1S/C9H19N.ClH/c1-8(7-10)9-5-3-2-4-6-9;/h8-9H,2-7,10H2,1H3;1H
InChIKeyHMAOUDLMOZCPRI-UHFFFAOYSA-N
MW177.72 g/mol
LogP2.58
Rot. Bonds2

About 2-cyclohexylpropan-1-amine;hydrochloride

2-cyclohexylpropan-1-amine;hydrochloride (PubChem CID 24837056) has the molecular formula C9H20ClN and a molecular weight of 177.72 g/mol. Its IUPAC name is 2-cyclohexylpropan-1-amine;hydrochloride.

Molecular Properties

Compound Name2-cyclohexylpropan-1-amine;hydrochloride
PubChem CID24837056
Molecular FormulaC9H20ClN
Molecular Weight177.72 g/mol
Exact Mass177.13
IUPAC Name2-cyclohexylpropan-1-amine;hydrochloride
SMILESCC(CN)C1CCCCC1.Cl
InChIInChI=1S/C9H19N.ClH/c1-8(7-10)9-5-3-2-4-6-9;/h8-9H,2-7,10H2,1H3;1H
InChIKeyHMAOUDLMOZCPRI-UHFFFAOYSA-N
XLogP2.58
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.72
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-cycloheptylpropan-1-amine
CID 96634967
2-(3-iodocyclooctyl)propan-1-amine
CID 170074117
butan-2-ylcyclohexadecane
CID 123713671
(2S)-2-cyclohexyl-3-methylbutan-1-amine
CID 96739435
(2R)-2-cyclohexylpropan-1-ol
CID 10176192
butan-2-ylcyclohexane;ethane
CID 143005290
butan-2-ylcyclohexane;ethane;propane
CID 143477078
1-cyclopentylpropan-2-ylcyclopentane
CID 57131610
butan-2-ylcyclopentane;ethane
CID 143236269
2-cyclopentyl-2-iodoethanamine
CID 134195934
2-cyclododecylpropan-1-ol;ethanol
CID 69400645
2-cycloheptyl-N-methylpropan-1-amine
CID 82931674

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylpropan-1-amine;hydrochloride?
The IUPAC name of 2-cyclohexylpropan-1-amine;hydrochloride (CID 24837056) is 2-cyclohexylpropan-1-amine;hydrochloride.
What is the SMILES notation for 2-cyclohexylpropan-1-amine;hydrochloride?
The canonical SMILES for 2-cyclohexylpropan-1-amine;hydrochloride is CC(CN)C1CCCCC1.Cl.
What is the InChIKey of 2-cyclohexylpropan-1-amine;hydrochloride?
The InChIKey is HMAOUDLMOZCPRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N.ClH/c1-8(7-10)9-5-3-2-4-6-9;/h8-9H,2-7,10H2,1H3;1H.
What are the key properties of 2-cyclohexylpropan-1-amine;hydrochloride?
2-cyclohexylpropan-1-amine;hydrochloride has a molecular weight of 177.72 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylpropan-1-amine;hydrochloride is sourced from PubChem (CID 24837056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).