4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine

C15H30N4 — CID 79483836

IUPAC4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine
SMILESCCC(CC)N(CC(C)C)c1c(CN)c(C)nn1C
InChIInChI=1S/C15H30N4/c1-7-13(8-2)19(10-11(3)4)15-14(9-16)12(5)17-18(15)6/h11,13H,7-10,16H2,1-6H3
InChIKeyLYLNSRGKNWLEIU-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.84
Rot. Bonds7

About 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine

4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine (PubChem CID 79483836) has the molecular formula C15H30N4 and a molecular weight of 266.43 g/mol. Its IUPAC name is 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine.

Molecular Properties

Compound Name4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine
PubChem CID79483836
Molecular FormulaC15H30N4
Molecular Weight266.43 g/mol
Exact Mass266.25
IUPAC Name4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine
SMILESCCC(CC)N(CC(C)C)c1c(CN)c(C)nn1C
InChIInChI=1S/C15H30N4/c1-7-13(8-2)19(10-11(3)4)15-14(9-16)12(5)17-18(15)6/h11,13H,7-10,16H2,1-6H3
InChIKeyLYLNSRGKNWLEIU-UHFFFAOYSA-N
XLogP2.84
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(chloromethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine
CID 79483802
1,3-dimethyl-5-[2-methylpropyl(pentan-3-yl)amino]pyrazole-4-carbothioamide
CID 79491037
4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine
CID 43296122
1-[[4-(aminomethyl)-1,3-dimethylpyrazol-5-yl]-methylamino]propan-2-ol
CID 62336030
4-(aminomethyl)-N-ethyl-1,3-dimethyl-N-propylpyrazol-5-amine
CID 43268986
4-(2-aminoethyl)-N-ethyl-N-(1-methoxypropan-2-yl)-1,3-dimethylpyrazol-5-amine
CID 63785849
4-[(tert-butylamino)methyl]-N-ethyl-1,3-dimethyl-N-(2-methylpropyl)pyrazol-5-amine
CID 63059837
4-(2-aminopropyl)-1,3-dimethyl-N-propan-2-yl-N-propylpyrazol-5-amine
CID 63785131
4-(2-aminoethyl)-N,1,3-trimethyl-N-(4-methylpentan-2-yl)pyrazol-5-amine
CID 55237561
4-(2-aminoethyl)-N-ethyl-N-(2-ethylbutyl)-1,3-dimethylpyrazol-5-amine
CID 55236586
N-butan-2-yl-N-(2-methoxyethyl)-1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-amine
CID 54999803
1,3-dimethyl-4-(methylaminomethyl)-N,N-bis(3-methylbutyl)pyrazol-5-amine
CID 107870543

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine?
The IUPAC name of 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine (CID 79483836) is 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine.
What is the SMILES notation for 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine?
The canonical SMILES for 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine is CCC(CC)N(CC(C)C)c1c(CN)c(C)nn1C.
What is the InChIKey of 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine?
The InChIKey is LYLNSRGKNWLEIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4/c1-7-13(8-2)19(10-11(3)4)15-14(9-16)12(5)17-18(15)6/h11,13H,7-10,16H2,1-6H3.
What are the key properties of 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine?
4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine has a molecular weight of 266.43 g/mol, XLogP of 2.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-1,3-dimethyl-N-(2-methylpropyl)-N-pentan-3-ylpyrazol-5-amine is sourced from PubChem (CID 79483836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).