N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine

C18H23N3 — CID 83109568

IUPACN-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine
SMILESCNC(C)c1ccc(N2CCC(c3ccccc3)C2)cn1
InChIInChI=1S/C18H23N3/c1-14(19-2)18-9-8-17(12-20-18)21-11-10-16(13-21)15-6-4-3-5-7-15/h3-9,12,14,16,19H,10-11,13H2,1-2H3
InChIKeySNULEERSHYNFPG-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.36
Rot. Bonds4

About N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine

N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine (PubChem CID 83109568) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine
PubChem CID83109568
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC NameN-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine
SMILESCNC(C)c1ccc(N2CCC(c3ccccc3)C2)cn1
InChIInChI=1S/C18H23N3/c1-14(19-2)18-9-8-17(12-20-18)21-11-10-16(13-21)15-6-4-3-5-7-15/h3-9,12,14,16,19H,10-11,13H2,1-2H3
InChIKeySNULEERSHYNFPG-UHFFFAOYSA-N
XLogP3.36
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-[1-(methylamino)ethyl]-3-pyridinyl]piperidin-4-ol
CID 83122210
(1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanamine
CID 78935368
(1R)-1-[4-(3-phenylpyrrolidin-1-yl)phenyl]ethanol
CID 78940951
2-[1-[6-[1-(methylamino)ethyl]-3-pyridinyl]piperidin-3-yl]ethanol
CID 107227793
N-[[1-[6-[1-(methylamino)ethyl]-3-pyridinyl]piperidin-4-yl]methyl]acetamide
CID 102736462
4-[6-[1-(methylamino)ethyl]-3-pyridinyl]piperazine-2,6-dione
CID 83127640
4-[methyl-[5-(3-phenylpiperidin-1-yl)-2-pyridinyl]amino]cyclohexan-1-ol
CID 135146872
N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)pyrazin-2-yl]methanamine
CID 107378764
5-(3-phenylpyrrolidin-1-yl)pyrazin-2-amine
CID 80652395
N-methyl-1-[5-(4-phenylpyrazol-1-yl)-2-pyridinyl]ethanamine
CID 83109942
1-[6-[1-(ethylamino)ethyl]-3-pyridinyl]piperidin-4-ol
CID 83122376
N-ethyl-1-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]ethanamine
CID 83131415

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine?
The IUPAC name of N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine (CID 83109568) is N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine.
What is the SMILES notation for N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine?
The canonical SMILES for N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine is CNC(C)c1ccc(N2CCC(c3ccccc3)C2)cn1.
What is the InChIKey of N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine?
The InChIKey is SNULEERSHYNFPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-14(19-2)18-9-8-17(12-20-18)21-11-10-16(13-21)15-6-4-3-5-7-15/h3-9,12,14,16,19H,10-11,13H2,1-2H3.
What are the key properties of N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine?
N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine has a molecular weight of 281.40 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[5-(3-phenylpyrrolidin-1-yl)-2-pyridinyl]ethanamine is sourced from PubChem (CID 83109568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).