butylcyclohexane;pyrrolidine

C14H29N — CID 145242408

IUPACbutylcyclohexane;pyrrolidine
SMILESC1CCNC1.CCCCC1CCCCC1
InChIInChI=1S/C10H20.C4H9N/c1-2-3-7-10-8-5-4-6-9-10;1-2-4-5-3-1/h10H,2-9H2,1H3;5H,1-4H2
InChIKeyFHZKTGLTYBXHBF-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.13
Rot. Bonds3

About butylcyclohexane;pyrrolidine

butylcyclohexane;pyrrolidine (PubChem CID 145242408) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is butylcyclohexane;pyrrolidine.

Molecular Properties

Compound Namebutylcyclohexane;pyrrolidine
PubChem CID145242408
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Namebutylcyclohexane;pyrrolidine
SMILESC1CCNC1.CCCCC1CCCCC1
InChIInChI=1S/C10H20.C4H9N/c1-2-3-7-10-8-5-4-6-9-10;1-2-4-5-3-1/h10H,2-9H2,1H3;5H,1-4H2
InChIKeyFHZKTGLTYBXHBF-UHFFFAOYSA-N
XLogP4.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-pentylazecane
CID 166829392
butylcyclohexane;N-methylmethanamine
CID 174941558
CID 171376493
CID 171376493
1-butyl-4-propylcyclononane
CID 123467552
1-butyl-4-(2-cyclopentylethyl)cyclohexane
CID 157379859
1-butyl-5-cyclohexylcyclopentadecane
CID 58552501
tetradecylcycloundecane
CID 169026040
docosylcyclohexane
CID 521991
tetradecylcyclododecane
CID 169026037
octylcyclotetradecane
CID 175261841
4-butylpiperidine;formonitrile
CID 142168007
azane;heptylcyclohexane
CID 121434222

Frequently Asked Questions

What is the IUPAC name of butylcyclohexane;pyrrolidine?
The IUPAC name of butylcyclohexane;pyrrolidine (CID 145242408) is butylcyclohexane;pyrrolidine.
What is the SMILES notation for butylcyclohexane;pyrrolidine?
The canonical SMILES for butylcyclohexane;pyrrolidine is C1CCNC1.CCCCC1CCCCC1.
What is the InChIKey of butylcyclohexane;pyrrolidine?
The InChIKey is FHZKTGLTYBXHBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20.C4H9N/c1-2-3-7-10-8-5-4-6-9-10;1-2-4-5-3-1/h10H,2-9H2,1H3;5H,1-4H2.
What are the key properties of butylcyclohexane;pyrrolidine?
butylcyclohexane;pyrrolidine has a molecular weight of 211.39 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butylcyclohexane;pyrrolidine is sourced from PubChem (CID 145242408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).