5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine

C15H20N4 — CID 114697982

IUPAC5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
SMILESCc1ccc(C)c(-c2cc(NC3CCNC3)n[nH]2)c1
InChIInChI=1S/C15H20N4/c1-10-3-4-11(2)13(7-10)14-8-15(19-18-14)17-12-5-6-16-9-12/h3-4,7-8,12,16H,5-6,9H2,1-2H3,(H2,17,18,19)
InChIKeyJWCWZKORROFXFD-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.47
Rot. Bonds3

About 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine

5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine (PubChem CID 114697982) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
PubChem CID114697982
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
SMILESCc1ccc(C)c(-c2cc(NC3CCNC3)n[nH]2)c1
InChIInChI=1S/C15H20N4/c1-10-3-4-11(2)13(7-10)14-8-15(19-18-14)17-12-5-6-16-9-12/h3-4,7-8,12,16H,5-6,9H2,1-2H3,(H2,17,18,19)
InChIKeyJWCWZKORROFXFD-UHFFFAOYSA-N
XLogP2.47
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2,4-dichlorophenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114697943
5-methyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine
CID 68833864
N-(4-methylphenyl)pyrrolidin-3-amine
CID 68925011
7-methyl-N-pyrrolidin-3-yl-1,4-dihydroindeno[2,1-d]pyrazol-3-amine
CID 114697907
N-pyrrolidin-3-yl-5-(1,3-thiazol-2-yl)-1H-pyrazol-3-amine
CID 114697887
5-naphthalen-2-yl-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114697920
4-(2,5-dimethylphenyl)-2-pyrrolidin-3-ylpyrimidine
CID 116898808
5-(3,4-difluorophenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114697923
5-(furan-2-yl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114698002
5-(4-methylsulfonylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114697922
5-(2-fluoro-6-methoxyphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114698005
5-(2,5-dimethylphenyl)-N-(2-methylpropyl)-1H-pyrazol-3-amine
CID 63049705

Frequently Asked Questions

What is the IUPAC name of 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine?
The IUPAC name of 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine (CID 114697982) is 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine?
The canonical SMILES for 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine is Cc1ccc(C)c(-c2cc(NC3CCNC3)n[nH]2)c1.
What is the InChIKey of 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine?
The InChIKey is JWCWZKORROFXFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10-3-4-11(2)13(7-10)14-8-15(19-18-14)17-12-5-6-16-9-12/h3-4,7-8,12,16H,5-6,9H2,1-2H3,(H2,17,18,19).
What are the key properties of 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine?
5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine has a molecular weight of 256.35 g/mol, XLogP of 2.47, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,5-dimethylphenyl)-N-pyrrolidin-3-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 114697982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).