1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine

C11H20N4 — CID 165389416

IUPAC1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine
SMILESCCCN1CC[C@H](c2cc(N)n(C)n2)C1
InChIInChI=1S/C11H20N4/c1-3-5-15-6-4-9(8-15)10-7-11(12)14(2)13-10/h7,9H,3-6,8,12H2,1-2H3/t9-/m0/s1
InChIKeyPKGXMQQGUZCXIH-VIFPVBQESA-N
MW208.31 g/mol
LogP1.20
Rot. Bonds3

About 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine

1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine (PubChem CID 165389416) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine
PubChem CID165389416
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine
SMILESCCCN1CC[C@H](c2cc(N)n(C)n2)C1
InChIInChI=1S/C11H20N4/c1-3-5-15-6-4-9(8-15)10-7-11(12)14(2)13-10/h7,9H,3-6,8,12H2,1-2H3/t9-/m0/s1
InChIKeyPKGXMQQGUZCXIH-VIFPVBQESA-N
XLogP1.20
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine 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 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine?
The IUPAC name of 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine (CID 165389416) is 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine.
What is the SMILES notation for 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine?
The canonical SMILES for 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine is CCCN1CC[C@H](c2cc(N)n(C)n2)C1.
What is the InChIKey of 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine?
The InChIKey is PKGXMQQGUZCXIH-VIFPVBQESA-N. The full InChI is InChI=1S/C11H20N4/c1-3-5-15-6-4-9(8-15)10-7-11(12)14(2)13-10/h7,9H,3-6,8,12H2,1-2H3/t9-/m0/s1.
What are the key properties of 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine?
1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine has a molecular weight of 208.31 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[(3S)-1-propylpyrrolidin-3-yl]pyrazol-5-amine is sourced from PubChem (CID 165389416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).