N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine

C19H24N6S — CID 110265171

IUPACN-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
SMILESCc1cnc(Nc2cccc(C3CCCN3Cc3cn(C)nc3C)n2)s1
InChIInChI=1S/C19H24N6S/c1-13-10-20-19(26-13)22-18-8-4-6-16(21-18)17-7-5-9-25(17)12-15-11-24(3)23-14(15)2/h4,6,8,10-11,17H,5,7,9,12H2,1-3H3,(H,20,21,22)
InChIKeyUCPJNTIKLXRZAB-UHFFFAOYSA-N
MW368.51 g/mol
LogP3.97
Rot. Bonds5

About N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine

N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine (PubChem CID 110265171) has the molecular formula C19H24N6S and a molecular weight of 368.51 g/mol. Its IUPAC name is N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
PubChem CID110265171
Molecular FormulaC19H24N6S
Molecular Weight368.51 g/mol
Exact Mass368.18
IUPAC NameN-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine
SMILESCc1cnc(Nc2cccc(C3CCCN3Cc3cn(C)nc3C)n2)s1
InChIInChI=1S/C19H24N6S/c1-13-10-20-19(26-13)22-18-8-4-6-16(21-18)17-7-5-9-25(17)12-15-11-24(3)23-14(15)2/h4,6,8,10-11,17H,5,7,9,12H2,1-3H3,(H,20,21,22)
InChIKeyUCPJNTIKLXRZAB-UHFFFAOYSA-N
XLogP3.97
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.51
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine?
The IUPAC name of N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine (CID 110265171) is N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine?
The canonical SMILES for N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine is Cc1cnc(Nc2cccc(C3CCCN3Cc3cn(C)nc3C)n2)s1.
What is the InChIKey of N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine?
The InChIKey is UCPJNTIKLXRZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6S/c1-13-10-20-19(26-13)22-18-8-4-6-16(21-18)17-7-5-9-25(17)12-15-11-24(3)23-14(15)2/h4,6,8,10-11,17H,5,7,9,12H2,1-3H3,(H,20,21,22).
What are the key properties of N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine?
N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine has a molecular weight of 368.51 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[1-[(1,3-dimethylpyrazol-4-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]-5-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 110265171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).