3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine

C12H19N3 — CID 82077199

IUPAC3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine
SMILESNCC(Cc1cccnc1)N1CCCC1
InChIInChI=1S/C12H19N3/c13-9-12(15-6-1-2-7-15)8-11-4-3-5-14-10-11/h3-5,10,12H,1-2,6-9,13H2
InChIKeyTZMKIZYDUGVUHF-UHFFFAOYSA-N
MW205.31 g/mol
LogP1.05
Rot. Bonds4

About 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine

3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine (PubChem CID 82077199) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound Name3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine
PubChem CID82077199
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine
SMILESNCC(Cc1cccnc1)N1CCCC1
InChIInChI=1S/C12H19N3/c13-9-12(15-6-1-2-7-15)8-11-4-3-5-14-10-11/h3-5,10,12H,1-2,6-9,13H2
InChIKeyTZMKIZYDUGVUHF-UHFFFAOYSA-N
XLogP1.05
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-piperidin-1-yl-2-pyridin-3-ylethanamine
CID 30075732
1-amino-3-pyridin-3-ylpropan-2-ol
CID 56924494
3-(4-bromophenyl)-2-piperidin-1-ylpropan-1-amine
CID 82094586
3-(2-chlorophenyl)-2-piperidin-1-ylpropan-1-amine
CID 82088060
1-cyclopentyl-2-pyridin-3-ylethanamine
CID 62553066
3-(pyrrolidin-1-ylmethyl)pyridine;dihydrochloride
CID 119103446
3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine
CID 104736500
N-ethyl-3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylbutan-2-amine
CID 104736482
3-ethyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-ol
CID 104736143
3-(2-pyrrolidin-1-ylethyl)pyridine
CID 23273673
2-[1-(pyridin-3-ylmethyl)piperidin-2-yl]ethanamine
CID 63759147
[1-(2-pyridin-3-ylethyl)piperidin-2-yl]methanamine
CID 63262844

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine (CID 82077199) is 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine is NCC(Cc1cccnc1)N1CCCC1.
What is the InChIKey of 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is TZMKIZYDUGVUHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c13-9-12(15-6-1-2-7-15)8-11-4-3-5-14-10-11/h3-5,10,12H,1-2,6-9,13H2.
What are the key properties of 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine?
3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 205.31 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-3-yl-2-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 82077199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).