N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine

C12H17N3 — CID 112709889

IUPACN-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine
SMILESc1nc(NC2CCNC2)cc2c1CCC2
InChIInChI=1S/C12H17N3/c1-2-9-6-12(14-7-10(9)3-1)15-11-4-5-13-8-11/h6-7,11,13H,1-5,8H2,(H,14,15)
InChIKeyYEBRCVMGENHMJT-UHFFFAOYSA-N
MW203.29 g/mol
LogP1.34
Rot. Bonds2

About N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine

N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine (PubChem CID 112709889) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine.

Molecular Properties

Compound NameN-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine
PubChem CID112709889
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC NameN-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine
SMILESc1nc(NC2CCNC2)cc2c1CCC2
InChIInChI=1S/C12H17N3/c1-2-9-6-12(14-7-10(9)3-1)15-11-4-5-13-8-11/h6-7,11,13H,1-5,8H2,(H,14,15)
InChIKeyYEBRCVMGENHMJT-UHFFFAOYSA-N
XLogP1.34
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine?
The IUPAC name of N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine (CID 112709889) is N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine.
What is the SMILES notation for N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine?
The canonical SMILES for N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine is c1nc(NC2CCNC2)cc2c1CCC2.
What is the InChIKey of N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine?
The InChIKey is YEBRCVMGENHMJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-2-9-6-12(14-7-10(9)3-1)15-11-4-5-13-8-11/h6-7,11,13H,1-5,8H2,(H,14,15).
What are the key properties of N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine?
N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine has a molecular weight of 203.29 g/mol, XLogP of 1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-3-yl-6,7-dihydro-5H-cyclopenta[c]pyridin-3-amine is sourced from PubChem (CID 112709889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).