(2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine

C11H21N3 — CID 97358257

IUPAC(2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine
SMILESCCn1nccc1CN[C@H](C)C(C)C
InChIInChI=1S/C11H21N3/c1-5-14-11(6-7-13-14)8-12-10(4)9(2)3/h6-7,9-10,12H,5,8H2,1-4H3/t10-/m1/s1
InChIKeyCCDXWUIJKHQHNZ-SNVBAGLBSA-N
MW195.31 g/mol
LogP2.04
Rot. Bonds5

About (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine

(2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine (PubChem CID 97358257) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine.

Molecular Properties

Compound Name(2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine
PubChem CID97358257
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name(2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine
SMILESCCn1nccc1CN[C@H](C)C(C)C
InChIInChI=1S/C11H21N3/c1-5-14-11(6-7-13-14)8-12-10(4)9(2)3/h6-7,9-10,12H,5,8H2,1-4H3/t10-/m1/s1
InChIKeyCCDXWUIJKHQHNZ-SNVBAGLBSA-N
XLogP2.04
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

2-[(2-ethylpyrazol-3-yl)methylamino]propane-1,3-diol
CID 115762526
3-methyl-N-[(2-propylpyrazol-3-yl)methyl]pentan-2-amine
CID 114555629
N-[(2-ethylpyrazol-3-yl)methyl]hexan-2-amine
CID 114555701
(1R)-1-cyclopentyl-N-[(2-ethylpyrazol-3-yl)methyl]ethanamine
CID 104939445
(1S)-1-cycloheptyl-N-[(2-ethylpyrazol-3-yl)methyl]ethanamine
CID 104587715
N-[(2-ethylpyrazol-3-yl)methyl]-1-(4-methoxyphenyl)ethanamine
CID 115762173
(1S)-N-[(2-ethylpyrazol-3-yl)methyl]-1-thiophen-2-ylethanamine
CID 104939449
(1R)-N-[(2-ethylpyrazol-3-yl)methyl]-1-(2-methoxyphenyl)ethanamine
CID 104939439
N-[(2-ethylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 115761765
1-(2,4-dimethylphenyl)-N-[(2-ethylpyrazol-3-yl)methyl]ethanamine
CID 115761847
1-(2,6-difluorophenyl)-N-[(2-ethylpyrazol-3-yl)methyl]propan-2-amine
CID 115761813
2-[(2-ethylpyrazol-3-yl)methylamino]-1-pyrrolidin-1-ylpropan-1-one
CID 115762300

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine?
The IUPAC name of (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine (CID 97358257) is (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine.
What is the SMILES notation for (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine?
The canonical SMILES for (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine is CCn1nccc1CN[C@H](C)C(C)C.
What is the InChIKey of (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine?
The InChIKey is CCDXWUIJKHQHNZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H21N3/c1-5-14-11(6-7-13-14)8-12-10(4)9(2)3/h6-7,9-10,12H,5,8H2,1-4H3/t10-/m1/s1.
What are the key properties of (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine?
(2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine has a molecular weight of 195.31 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2-ethylpyrazol-3-yl)methyl]-3-methylbutan-2-amine is sourced from PubChem (CID 97358257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).