5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine

C14H27N5 — CID 66011553

IUPAC5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine
SMILESCC(C)c1nn(C)c(N(C)CC2CCN(C)C2)c1N
InChIInChI=1S/C14H27N5/c1-10(2)13-12(15)14(19(5)16-13)18(4)9-11-6-7-17(3)8-11/h10-11H,6-9,15H2,1-5H3
InChIKeyMTJGDCWWVYMIRL-UHFFFAOYSA-N
MW265.40 g/mol
LogP1.51
Rot. Bonds4

About 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine

5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine (PubChem CID 66011553) has the molecular formula C14H27N5 and a molecular weight of 265.40 g/mol. Its IUPAC name is 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine.

Molecular Properties

Compound Name5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine
PubChem CID66011553
Molecular FormulaC14H27N5
Molecular Weight265.40 g/mol
Exact Mass265.23
IUPAC Name5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine
SMILESCC(C)c1nn(C)c(N(C)CC2CCN(C)C2)c1N
InChIInChI=1S/C14H27N5/c1-10(2)13-12(15)14(19(5)16-13)18(4)9-11-6-7-17(3)8-11/h10-11H,6-9,15H2,1-5H3
InChIKeyMTJGDCWWVYMIRL-UHFFFAOYSA-N
XLogP1.51
TPSA50.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine with MolForge

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Related Compounds

4-(aminomethyl)-N,1,3-trimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazol-5-amine
CID 63274020
1-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)-methylamino]propan-2-ol
CID 66019786
5-N,1-dimethyl-5-N-[(1-methylpiperidin-4-yl)methyl]-3-propylpyrazole-4,5-diamine
CID 66018897
4-(2-aminoethyl)-N,1,3-trimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazol-5-amine
CID 63782929
5-N,3-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-1-propylpyrazole-4,5-diamine
CID 66027665
5-N-(2,2-dimethylpropyl)-5-N,1-dimethyl-3-propan-2-ylpyrazole-4,5-diamine
CID 66019013
2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)-methylamino]ethanol
CID 66019160
5-N,1-dimethyl-5-N-[2-(methylamino)ethyl]-3-propan-2-ylpyrazole-4,5-diamine
CID 66011559
1-methyl-5-(1-methylpyrrolidin-3-yl)oxy-3-propan-2-ylpyrazol-4-amine
CID 112741274
5-N-cyclopropyl-1-methyl-5-N-(3-methylbutyl)-3-propan-2-ylpyrazole-4,5-diamine
CID 79026644
5-N,1-dimethyl-5-N-[(1-methylimidazol-2-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine
CID 66012525
5-N-(cyclohexylmethyl)-5-N,1,3-trimethylpyrazole-4,5-diamine
CID 61444659

Frequently Asked Questions

What is the IUPAC name of 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine?
The IUPAC name of 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine (CID 66011553) is 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine.
What is the SMILES notation for 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine?
The canonical SMILES for 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine is CC(C)c1nn(C)c(N(C)CC2CCN(C)C2)c1N.
What is the InChIKey of 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine?
The InChIKey is MTJGDCWWVYMIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5/c1-10(2)13-12(15)14(19(5)16-13)18(4)9-11-6-7-17(3)8-11/h10-11H,6-9,15H2,1-5H3.
What are the key properties of 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine?
5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine has a molecular weight of 265.40 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N,1-dimethyl-5-N-[(1-methylpyrrolidin-3-yl)methyl]-3-propan-2-ylpyrazole-4,5-diamine is sourced from PubChem (CID 66011553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).