10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride

C22H46ClN — CID 173360948

IUPAC10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride
SMILESCCCN(CCC)CCCCCCCCCCC1CCCCC1.Cl
InChIInChI=1S/C22H45N.ClH/c1-3-19-23(20-4-2)21-15-10-8-6-5-7-9-12-16-22-17-13-11-14-18-22;/h22H,3-21H2,1-2H3;1H
InChIKeyDGTZUTMTQAYAAF-UHFFFAOYSA-N
MW360.07 g/mol
LogP7.62
Rot. Bonds15

About 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride

10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride (PubChem CID 173360948) has the molecular formula C22H46ClN and a molecular weight of 360.07 g/mol. Its IUPAC name is 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride.

Molecular Properties

Compound Name10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride
PubChem CID173360948
Molecular FormulaC22H46ClN
Molecular Weight360.07 g/mol
Exact Mass359.33
IUPAC Name10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride
SMILESCCCN(CCC)CCCCCCCCCCC1CCCCC1.Cl
InChIInChI=1S/C22H45N.ClH/c1-3-19-23(20-4-2)21-15-10-8-6-5-7-9-12-16-22-17-13-11-14-18-22;/h22H,3-21H2,1-2H3;1H
InChIKeyDGTZUTMTQAYAAF-UHFFFAOYSA-N
XLogP7.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.07
LogP ≤ 57.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

10-cyclohexyl-N,N-diethyldecan-1-amine;hydrate
CID 173347428
tetradecylcycloundecane
CID 169026040
docosylcyclohexane
CID 521991
octylcyclotetradecane
CID 175261841
tetradecylcyclododecane
CID 169026037
azane;heptylcyclohexane
CID 121434222
2-[7-cyclopentadecylheptyl(10-propan-2-ylhexadecyl)amino]ethanol
CID 177194022
4-cyclopentylbutylcyclohexane
CID 144547696
N',N'-bis(2-cyclohexylethyl)-N,N-dimethylpropane-1,3-diamine;hydrochloride
CID 54609597
4-[cyclohexylmethyl(propyl)amino]butan-1-ol
CID 110931716
heptylcyclohexane;propan-2-one
CID 143570854
ethene;pentylcyclopentane
CID 145442606

Frequently Asked Questions

What is the IUPAC name of 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride?
The IUPAC name of 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride (CID 173360948) is 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride.
What is the SMILES notation for 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride?
The canonical SMILES for 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride is CCCN(CCC)CCCCCCCCCCC1CCCCC1.Cl.
What is the InChIKey of 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride?
The InChIKey is DGTZUTMTQAYAAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H45N.ClH/c1-3-19-23(20-4-2)21-15-10-8-6-5-7-9-12-16-22-17-13-11-14-18-22;/h22H,3-21H2,1-2H3;1H.
What are the key properties of 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride?
10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride has a molecular weight of 360.07 g/mol, XLogP of 7.62, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10-cyclohexyl-N,N-dipropyldecan-1-amine;hydrochloride is sourced from PubChem (CID 173360948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).