N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine

C14H19N5 — CID 54881297

IUPACN-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine
SMILESCC(Nc1cccnc1N1CCCC1)c1ccn[nH]1
InChIInChI=1S/C14H19N5/c1-11(12-6-8-16-18-12)17-13-5-4-7-15-14(13)19-9-2-3-10-19/h4-8,11,17H,2-3,9-10H2,1H3,(H,16,18)
InChIKeyVBBMZKGNHONQSR-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.58
Rot. Bonds4

About N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine

N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine (PubChem CID 54881297) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine
PubChem CID54881297
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC NameN-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine
SMILESCC(Nc1cccnc1N1CCCC1)c1ccn[nH]1
InChIInChI=1S/C14H19N5/c1-11(12-6-8-16-18-12)17-13-5-4-7-15-14(13)19-9-2-3-10-19/h4-8,11,17H,2-3,9-10H2,1H3,(H,16,18)
InChIKeyVBBMZKGNHONQSR-UHFFFAOYSA-N
XLogP2.58
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-iodophenyl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 43779579
N-[1-(1H-pyrazol-5-yl)ethyl]-2-(pyrrolidin-1-ylmethyl)aniline
CID 60971669
N-[1-(1H-pyrazol-5-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 54881348
3-[1-[(2-pyrrolidin-1-yl-3-pyridinyl)amino]ethyl]phenol
CID 43676485
2-methyl-3-[(2-pyrrolidin-1-yl-3-pyridinyl)amino]butan-2-ol
CID 65338174
N-(1-cyclobutylpropan-2-yl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 115922136
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676363
N-(1-ethylsulfonylpropan-2-yl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 115922139
N-nonan-2-yl-2-pyrrolidin-1-ylpyridin-3-amine
CID 43676446
2-(2-methylpropoxy)-N-[1-(1H-pyrazol-5-yl)ethyl]aniline
CID 54881549
N-[2-[1-(1H-pyrazol-5-yl)ethylamino]phenyl]methanesulfonamide
CID 54881791
N-(3-methylcyclopentyl)-2-pyrrolidin-1-ylpyridin-3-amine
CID 64500200

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine?
The IUPAC name of N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine (CID 54881297) is N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine.
What is the SMILES notation for N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine?
The canonical SMILES for N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine is CC(Nc1cccnc1N1CCCC1)c1ccn[nH]1.
What is the InChIKey of N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine?
The InChIKey is VBBMZKGNHONQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-11(12-6-8-16-18-12)17-13-5-4-7-15-14(13)19-9-2-3-10-19/h4-8,11,17H,2-3,9-10H2,1H3,(H,16,18).
What are the key properties of N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine?
N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine has a molecular weight of 257.34 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-pyrazol-5-yl)ethyl]-2-pyrrolidin-1-ylpyridin-3-amine is sourced from PubChem (CID 54881297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).