N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine

C16H21N5 — CID 102613252

IUPACN-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
SMILESCc1nccnc1C(C)Nc1ccc(N2CCCC2)nc1
InChIInChI=1S/C16H21N5/c1-12-16(18-8-7-17-12)13(2)20-14-5-6-15(19-11-14)21-9-3-4-10-21/h5-8,11,13,20H,3-4,9-10H2,1-2H3
InChIKeyYLYHFFSLQKERDR-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.95
Rot. Bonds4

About N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine

N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine (PubChem CID 102613252) has the molecular formula C16H21N5 and a molecular weight of 283.38 g/mol. Its IUPAC name is N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
PubChem CID102613252
Molecular FormulaC16H21N5
Molecular Weight283.38 g/mol
Exact Mass283.18
IUPAC NameN-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
SMILESCc1nccnc1C(C)Nc1ccc(N2CCCC2)nc1
InChIInChI=1S/C16H21N5/c1-12-16(18-8-7-17-12)13(2)20-14-5-6-15(19-11-14)21-9-3-4-10-21/h5-8,11,13,20H,3-4,9-10H2,1-2H3
InChIKeyYLYHFFSLQKERDR-UHFFFAOYSA-N
XLogP2.95
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(furan-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689581
N-[1-(1H-pyrazol-5-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 54881348
N-[1-(4-bromophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689538
N-[1-(5-methylthiophen-2-yl)ethyl]-6-piperidin-1-ylpyridin-3-amine
CID 43690335
N-[1-(2-chlorophenyl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689544
N-pentan-2-yl-6-piperidin-1-ylpyridin-3-amine
CID 43690334
N-ethyl-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689606
N-hex-5-en-2-yl-6-piperidin-1-ylpyridin-3-amine
CID 104584130
(6-piperidin-1-yl-3-pyridinyl)hydrazine
CID 55281305
N-(2-methylbutyl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 43689479
N-(1-ethoxypropan-2-yl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 115922081
N-(1-cyclobutylpropan-2-yl)-6-pyrrolidin-1-ylpyridin-3-amine
CID 115922079

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine?
The IUPAC name of N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine (CID 102613252) is N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine.
What is the SMILES notation for N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine?
The canonical SMILES for N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine is Cc1nccnc1C(C)Nc1ccc(N2CCCC2)nc1.
What is the InChIKey of N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine?
The InChIKey is YLYHFFSLQKERDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N5/c1-12-16(18-8-7-17-12)13(2)20-14-5-6-15(19-11-14)21-9-3-4-10-21/h5-8,11,13,20H,3-4,9-10H2,1-2H3.
What are the key properties of N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine?
N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine has a molecular weight of 283.38 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylpyrazin-2-yl)ethyl]-6-pyrrolidin-1-ylpyridin-3-amine is sourced from PubChem (CID 102613252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).