2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine

C15H21N3 — CID 166703395

IUPAC2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine
SMILESC=C1CCC(CNC2CCc3nc(C)ccc32)N1
InChIInChI=1S/C15H21N3/c1-10-3-5-12(17-10)9-16-14-7-8-15-13(14)6-4-11(2)18-15/h4,6,12,14,16-17H,1,3,5,7-9H2,2H3
InChIKeyYGMAIGUFNLYTLJ-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.23
Rot. Bonds3

About 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine

2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine (PubChem CID 166703395) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine.

Molecular Properties

Compound Name2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine
PubChem CID166703395
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine
SMILESC=C1CCC(CNC2CCc3nc(C)ccc32)N1
InChIInChI=1S/C15H21N3/c1-10-3-5-12(17-10)9-16-14-7-8-15-13(14)6-4-11(2)18-15/h4,6,12,14,16-17H,1,3,5,7-9H2,2H3
InChIKeyYGMAIGUFNLYTLJ-UHFFFAOYSA-N
XLogP2.23
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine?
The IUPAC name of 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine (CID 166703395) is 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine.
What is the SMILES notation for 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine?
The canonical SMILES for 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine is C=C1CCC(CNC2CCc3nc(C)ccc32)N1.
What is the InChIKey of 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine?
The InChIKey is YGMAIGUFNLYTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-10-3-5-12(17-10)9-16-14-7-8-15-13(14)6-4-11(2)18-15/h4,6,12,14,16-17H,1,3,5,7-9H2,2H3.
What are the key properties of 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine?
2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine has a molecular weight of 243.35 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(5-methylidenepyrrolidin-2-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine is sourced from PubChem (CID 166703395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).