1-methylspiro[adamantane-2,2'-pyrrolidine]

C14H23N — CID 90318350

IUPAC1-methylspiro[adamantane-2,2'-pyrrolidine]
SMILESCC12CC3CC(CC(C3)C13CCCN3)C2
InChIInChI=1S/C14H23N/c1-13-8-10-5-11(9-13)7-12(6-10)14(13)3-2-4-15-14/h10-12,15H,2-9H2,1H3
InChIKeyWACQHRBCONRFMC-UHFFFAOYSA-N
MW205.34 g/mol
LogP2.95
Rot. Bonds

About 1-methylspiro[adamantane-2,2'-pyrrolidine]

1-methylspiro[adamantane-2,2'-pyrrolidine] (PubChem CID 90318350) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 1-methylspiro[adamantane-2,2'-pyrrolidine].

Molecular Properties

Compound Name1-methylspiro[adamantane-2,2'-pyrrolidine]
PubChem CID90318350
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name1-methylspiro[adamantane-2,2'-pyrrolidine]
SMILESCC12CC3CC(CC(C3)C13CCCN3)C2
InChIInChI=1S/C14H23N/c1-13-8-10-5-11(9-13)7-12(6-10)14(13)3-2-4-15-14/h10-12,15H,2-9H2,1H3
InChIKeyWACQHRBCONRFMC-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-methylspiro[adamantane-2,2'-pyrrolidine]?
The IUPAC name of 1-methylspiro[adamantane-2,2'-pyrrolidine] (CID 90318350) is 1-methylspiro[adamantane-2,2'-pyrrolidine].
What is the SMILES notation for 1-methylspiro[adamantane-2,2'-pyrrolidine]?
The canonical SMILES for 1-methylspiro[adamantane-2,2'-pyrrolidine] is CC12CC3CC(CC(C3)C13CCCN3)C2.
What is the InChIKey of 1-methylspiro[adamantane-2,2'-pyrrolidine]?
The InChIKey is WACQHRBCONRFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N/c1-13-8-10-5-11(9-13)7-12(6-10)14(13)3-2-4-15-14/h10-12,15H,2-9H2,1H3.
What are the key properties of 1-methylspiro[adamantane-2,2'-pyrrolidine]?
1-methylspiro[adamantane-2,2'-pyrrolidine] has a molecular weight of 205.34 g/mol, XLogP of 2.95, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylspiro[adamantane-2,2'-pyrrolidine] is sourced from PubChem (CID 90318350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).