5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine

C7H14N4 — CID 83863940

IUPAC5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine
SMILESCC(C)n1nc(N)cc1CN
InChIInChI=1S/C7H14N4/c1-5(2)11-6(4-8)3-7(9)10-11/h3,5H,4,8H2,1-2H3,(H2,9,10)
InChIKeyQXCAVJYDAUKPLK-UHFFFAOYSA-N
MW154.22 g/mol
LogP0.50
Rot. Bonds2

About 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine

5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine (PubChem CID 83863940) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine.

Molecular Properties

Compound Name5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine
PubChem CID83863940
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC Name5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine
SMILESCC(C)n1nc(N)cc1CN
InChIInChI=1S/C7H14N4/c1-5(2)11-6(4-8)3-7(9)10-11/h3,5H,4,8H2,1-2H3,(H2,9,10)
InChIKeyQXCAVJYDAUKPLK-UHFFFAOYSA-N
XLogP0.50
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-aminoethyl)-1-propan-2-ylpyrazol-3-amine
CID 83863937
5-(methylsulfonylmethyl)-1-propan-2-ylpyrazol-3-amine
CID 117217260
(3-amino-1-propan-2-ylpyrazol-5-yl)boronic acid
CID 69090415
5-[(1R,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]-1-propan-2-ylpyrazol-3-amine
CID 90292774
3-amino-N,N-diethyl-1-propan-2-ylpyrazole-5-carboxamide
CID 132586396
1-(difluoromethyl)-5-propan-2-ylpyrazol-3-amine
CID 169166896
5-(2-aminoethyl)-1-methylpyrazol-3-amine
CID 83864147
2-(3-amino-5-methylpyrazol-1-yl)propanoic acid
CID 19620619
[1,3-di(propan-2-yl)pyrazol-5-yl]methanol
CID 167336895
4-(aminomethyl)-1-propan-2-ylpyrazol-5-amine
CID 115069507
1-methyl-5-(methylsulfanylmethyl)pyrazol-3-amine
CID 117217176
5-ethylpyrazole-1,3-diamine
CID 123239006

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine?
The IUPAC name of 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine (CID 83863940) is 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine.
What is the SMILES notation for 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine?
The canonical SMILES for 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine is CC(C)n1nc(N)cc1CN.
What is the InChIKey of 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine?
The InChIKey is QXCAVJYDAUKPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4/c1-5(2)11-6(4-8)3-7(9)10-11/h3,5H,4,8H2,1-2H3,(H2,9,10).
What are the key properties of 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine?
5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine has a molecular weight of 154.22 g/mol, XLogP of 0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-1-propan-2-ylpyrazol-3-amine is sourced from PubChem (CID 83863940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).