N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine

C20H25N7 — CID 110111526

IUPACN-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
SMILESCc1nn(C)c(C)c1CN1CCCC1c1ccnc(Nc2cnccn2)c1
InChIInChI=1S/C20H25N7/c1-14-17(15(2)26(3)25-14)13-27-10-4-5-18(27)16-6-7-22-19(11-16)24-20-12-21-8-9-23-20/h6-9,11-12,18H,4-5,10,13H2,1-3H3,(H,22,23,24)
InChIKeyOQCWFBZADQRZEE-UHFFFAOYSA-N
MW363.47 g/mol
LogP3.30
Rot. Bonds5

About N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine

N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine (PubChem CID 110111526) has the molecular formula C20H25N7 and a molecular weight of 363.47 g/mol. Its IUPAC name is N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
PubChem CID110111526
Molecular FormulaC20H25N7
Molecular Weight363.47 g/mol
Exact Mass363.22
IUPAC NameN-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
SMILESCc1nn(C)c(C)c1CN1CCCC1c1ccnc(Nc2cnccn2)c1
InChIInChI=1S/C20H25N7/c1-14-17(15(2)26(3)25-14)13-27-10-4-5-18(27)16-6-7-22-19(11-16)24-20-12-21-8-9-23-20/h6-9,11-12,18H,4-5,10,13H2,1-3H3,(H,22,23,24)
InChIKeyOQCWFBZADQRZEE-UHFFFAOYSA-N
XLogP3.30
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

N-[4-[(2S)-1-[(3-methylimidazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 124946260
N-[4-[(2R)-1-[(3-methylimidazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 124946261
N-[4-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 110097759
N-[4-[(2S)-1-[(2-methoxypyrimidin-5-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 125004240
N,N-dimethyl-2-[2-[2-(pyrazin-2-ylamino)-4-pyridinyl]pyrrolidin-1-yl]acetamide
CID 110097688
N,N-dimethyl-2-[(2R)-2-[2-(pyrazin-2-ylamino)-4-pyridinyl]pyrrolidin-1-yl]acetamide
CID 124971029
N-[4-[1-(6-methylpyrimidin-4-yl)pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine
CID 127245198
2-methyl-6-[(2S)-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-N-pyrazin-2-ylpyrimidin-4-amine
CID 95820587
(5-methyl-3-pyridinyl)-[2-[2-(pyrazin-2-ylamino)-4-pyridinyl]pyrrolidin-1-yl]methanone
CID 110111645
2-methyl-6-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-2-yl]-N-pyrazin-2-ylpyrimidin-4-amine
CID 110095459
N-[4-[1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]-2-pyridinyl]pyrazin-2-amine
CID 110111840
N-[[6-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-3-pyridinyl]methyl]acetamide
CID 110107855

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The IUPAC name of N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine (CID 110111526) is N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine.
What is the SMILES notation for N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The canonical SMILES for N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine is Cc1nn(C)c(C)c1CN1CCCC1c1ccnc(Nc2cnccn2)c1.
What is the InChIKey of N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine?
The InChIKey is OQCWFBZADQRZEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N7/c1-14-17(15(2)26(3)25-14)13-27-10-4-5-18(27)16-6-7-22-19(11-16)24-20-12-21-8-9-23-20/h6-9,11-12,18H,4-5,10,13H2,1-3H3,(H,22,23,24).
What are the key properties of N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine?
N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine has a molecular weight of 363.47 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]pyrazin-2-amine is sourced from PubChem (CID 110111526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).