cyclohexylmethanamine;hydrochloride

C7H16ClN — CID 3039618

IUPACcyclohexylmethanamine;hydrochloride
SMILESCl.NCC1CCCCC1
InChIInChI=1S/C7H15N.ClH/c8-6-7-4-2-1-3-5-7;/h7H,1-6,8H2;1H
InChIKeyQEYHQERVRCNZHN-UHFFFAOYSA-N
MW149.66 g/mol
LogP1.95
Rot. Bonds1

About cyclohexylmethanamine;hydrochloride

cyclohexylmethanamine;hydrochloride (PubChem CID 3039618) has the molecular formula C7H16ClN and a molecular weight of 149.66 g/mol. Its IUPAC name is cyclohexylmethanamine;hydrochloride.

Molecular Properties

Compound Namecyclohexylmethanamine;hydrochloride
PubChem CID3039618
Molecular FormulaC7H16ClN
Molecular Weight149.66 g/mol
Exact Mass149.10
IUPAC Namecyclohexylmethanamine;hydrochloride
SMILESCl.NCC1CCCCC1
InChIInChI=1S/C7H15N.ClH/c8-6-7-4-2-1-3-5-7;/h7H,1-6,8H2;1H
InChIKeyQEYHQERVRCNZHN-UHFFFAOYSA-N
XLogP1.95
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.66
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclohexylmethanamine;hydrobromide
CID 13001131
cyclohexylmethanamine;methanol
CID 70430105
cyclohexanamine;cyclohexylmethanamine
CID 174974863
carbonic acid;cyclohexylmethanamine
CID 67545146
[4-(aminomethyl)cyclohexyl]methanamine
CID 158172497
carbonyl dichloride;cyclopentylmethanamine
CID 175500513
(5-methylcyclononyl)methanamine
CID 91548607
butane;cyclopentane;cyclopentylmethanamine;ethanamine;methane;yttrium
CID 158510673
[(1S,3S)-3-(aminomethyl)cyclohexyl]methanamine
CID 6951512
(4-cyclohexyloxycyclohexyl)methanamine
CID 83835102
4-cyclohexylbut-2-en-1-amine;hydrochloride
CID 67913983
(5,5-dimethylcyclononyl)methanamine
CID 129138997

Frequently Asked Questions

What is the IUPAC name of cyclohexylmethanamine;hydrochloride?
The IUPAC name of cyclohexylmethanamine;hydrochloride (CID 3039618) is cyclohexylmethanamine;hydrochloride.
What is the SMILES notation for cyclohexylmethanamine;hydrochloride?
The canonical SMILES for cyclohexylmethanamine;hydrochloride is Cl.NCC1CCCCC1.
What is the InChIKey of cyclohexylmethanamine;hydrochloride?
The InChIKey is QEYHQERVRCNZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.ClH/c8-6-7-4-2-1-3-5-7;/h7H,1-6,8H2;1H.
What are the key properties of cyclohexylmethanamine;hydrochloride?
cyclohexylmethanamine;hydrochloride has a molecular weight of 149.66 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethanamine;hydrochloride is sourced from PubChem (CID 3039618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).