N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine

C14H26N2 — CID 2845276

IUPACN-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
SMILESCN1CCCC1CCNC1CC2CCC1C2
InChIInChI=1S/C14H26N2/c1-16-8-2-3-13(16)6-7-15-14-10-11-4-5-12(14)9-11/h11-15H,2-10H2,1H3
InChIKeyHTGVPRBEUIGJSV-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.25
Rot. Bonds4

About N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine

N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine (PubChem CID 2845276) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine.

Molecular Properties

Compound NameN-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
PubChem CID2845276
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
SMILESCN1CCCC1CCNC1CC2CCC1C2
InChIInChI=1S/C14H26N2/c1-16-8-2-3-13(16)6-7-15-14-10-11-4-5-12(14)9-11/h11-15H,2-10H2,1H3
InChIKeyHTGVPRBEUIGJSV-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine?
The IUPAC name of N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine (CID 2845276) is N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine.
What is the SMILES notation for N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine?
The canonical SMILES for N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine is CN1CCCC1CCNC1CC2CCC1C2.
What is the InChIKey of N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine?
The InChIKey is HTGVPRBEUIGJSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-16-8-2-3-13(16)6-7-15-14-10-11-4-5-12(14)9-11/h11-15H,2-10H2,1H3.
What are the key properties of N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine?
N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine has a molecular weight of 222.38 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpyrrolidin-2-yl)ethyl]bicyclo[2.2.1]heptan-2-amine is sourced from PubChem (CID 2845276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).