5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine

C11H23N5 — CID 66018172

IUPAC5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
SMILESCC(C)c1nn(C)c(NCCN(C)C)c1N
InChIInChI=1S/C11H23N5/c1-8(2)10-9(12)11(16(5)14-10)13-6-7-15(3)4/h8,13H,6-7,12H2,1-5H3
InChIKeyICCSLAXCMJZPCB-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.10
Rot. Bonds5

About 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine

5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine (PubChem CID 66018172) has the molecular formula C11H23N5 and a molecular weight of 225.34 g/mol. Its IUPAC name is 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
PubChem CID66018172
Molecular FormulaC11H23N5
Molecular Weight225.34 g/mol
Exact Mass225.20
IUPAC Name5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
SMILESCC(C)c1nn(C)c(NCCN(C)C)c1N
InChIInChI=1S/C11H23N5/c1-8(2)10-9(12)11(16(5)14-10)13-6-7-15(3)4/h8,13H,6-7,12H2,1-5H3
InChIKeyICCSLAXCMJZPCB-UHFFFAOYSA-N
XLogP1.10
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)amino]ethyl]-1,1-dimethylurea
CID 83116434
5-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)amino]pentan-2-ol
CID 114146037
2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)amino]-N,N-dimethylacetamide
CID 66018194
5-N-(3-ethylsulfanylpropyl)-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 114247802
5-N-(cyclopropylmethyl)-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 66018365
2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)amino]acetic acid
CID 66019776
1-methyl-5-N,3-di(propan-2-yl)pyrazole-4,5-diamine
CID 66017780
5-N-(2-methoxy-2-methylpropyl)-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 104758808
1-methyl-3-propan-2-yl-5-N-(2-pyridin-2-ylethyl)pyrazole-4,5-diamine
CID 66017201
2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)amino]-N-methylacetamide
CID 66018193
5-N-[2-(cyclohexen-1-yl)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 107845996
5-N-[(1-methoxycyclobutyl)methyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 114118785

Frequently Asked Questions

What is the IUPAC name of 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine?
The IUPAC name of 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine (CID 66018172) is 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine?
The canonical SMILES for 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine is CC(C)c1nn(C)c(NCCN(C)C)c1N.
What is the InChIKey of 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine?
The InChIKey is ICCSLAXCMJZPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N5/c1-8(2)10-9(12)11(16(5)14-10)13-6-7-15(3)4/h8,13H,6-7,12H2,1-5H3.
What are the key properties of 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine?
5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine has a molecular weight of 225.34 g/mol, XLogP of 1.10, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[2-(dimethylamino)ethyl]-1-methyl-3-propan-2-ylpyrazole-4,5-diamine is sourced from PubChem (CID 66018172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).