1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine

C19H22N2 — CID 63263215

IUPAC1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine
SMILESCNCC1CCN(C2c3ccccc3-c3ccccc32)C1
InChIInChI=1S/C19H22N2/c1-20-12-14-10-11-21(13-14)19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,14,19-20H,10-13H2,1H3
InChIKeyROYQCRLAFZGGLD-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.30
Rot. Bonds3

About 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine

1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine (PubChem CID 63263215) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine
PubChem CID63263215
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC Name1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine
SMILESCNCC1CCN(C2c3ccccc3-c3ccccc32)C1
InChIInChI=1S/C19H22N2/c1-20-12-14-10-11-21(13-14)19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,14,19-20H,10-13H2,1H3
InChIKeyROYQCRLAFZGGLD-UHFFFAOYSA-N
XLogP3.30
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine (CID 63263215) is 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine is CNCC1CCN(C2c3ccccc3-c3ccccc32)C1.
What is the InChIKey of 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine?
The InChIKey is ROYQCRLAFZGGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-20-12-14-10-11-21(13-14)19-17-8-4-2-6-15(17)16-7-3-5-9-18(16)19/h2-9,14,19-20H,10-13H2,1H3.
What are the key properties of 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine?
1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine has a molecular weight of 278.40 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 63263215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).