[6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone

C19H25N5O — CID 56779570

IUPAC[6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone
SMILESCc1cc(C)n(CC2CCCN2C(=O)c2ccc(NC3CC3)nc2)n1
InChIInChI=1S/C19H25N5O/c1-13-10-14(2)24(22-13)12-17-4-3-9-23(17)19(25)15-5-8-18(20-11-15)21-16-6-7-16/h5,8,10-11,16-17H,3-4,6-7,9,12H2,1-2H3,(H,20,21)
InChIKeyFFJIFKSUJUICFI-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.77
Rot. Bonds5

About [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone

[6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone (PubChem CID 56779570) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name[6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone
PubChem CID56779570
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name[6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone
SMILESCc1cc(C)n(CC2CCCN2C(=O)c2ccc(NC3CC3)nc2)n1
InChIInChI=1S/C19H25N5O/c1-13-10-14(2)24(22-13)12-17-4-3-9-23(17)19(25)15-5-8-18(20-11-15)21-16-6-7-16/h5,8,10-11,16-17H,3-4,6-7,9,12H2,1-2H3,(H,20,21)
InChIKeyFFJIFKSUJUICFI-UHFFFAOYSA-N
XLogP2.77
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone?
The IUPAC name of [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone (CID 56779570) is [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone.
What is the SMILES notation for [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone?
The canonical SMILES for [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone is Cc1cc(C)n(CC2CCCN2C(=O)c2ccc(NC3CC3)nc2)n1.
What is the InChIKey of [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone?
The InChIKey is FFJIFKSUJUICFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-13-10-14(2)24(22-13)12-17-4-3-9-23(17)19(25)15-5-8-18(20-11-15)21-16-6-7-16/h5,8,10-11,16-17H,3-4,6-7,9,12H2,1-2H3,(H,20,21).
What are the key properties of [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone?
[6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone has a molecular weight of 339.44 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(cyclopropylamino)-3-pyridinyl]-[2-[(3,5-dimethylpyrazol-1-yl)methyl]pyrrolidin-1-yl]methanone is sourced from PubChem (CID 56779570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).