2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine

C11H22N4 — CID 66441376

IUPAC2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine
SMILESCCCc1c(CN)cnn1CCN(C)C
InChIInChI=1S/C11H22N4/c1-4-5-11-10(8-12)9-13-15(11)7-6-14(2)3/h9H,4-8,12H2,1-3H3
InChIKeyHZEGSZFSXQHVRL-UHFFFAOYSA-N
MW210.32 g/mol
LogP0.86
Rot. Bonds6

About 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine

2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine (PubChem CID 66441376) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine
PubChem CID66441376
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC Name2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine
SMILESCCCc1c(CN)cnn1CCN(C)C
InChIInChI=1S/C11H22N4/c1-4-5-11-10(8-12)9-13-15(11)7-6-14(2)3/h9H,4-8,12H2,1-3H3
InChIKeyHZEGSZFSXQHVRL-UHFFFAOYSA-N
XLogP0.86
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine
CID 66440973
N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-1-amine
CID 66441173
2-[4-(aminomethyl)-5-propan-2-ylpyrazol-1-yl]-N,N-dimethylethanamine
CID 66439965
2-[5-(aminomethyl)-4-chloropyrazol-1-yl]-N,N-dimethylethanamine
CID 114652025
[1-[2-(dimethylamino)ethyl]-5-ethylpyrazol-4-yl]methanol
CID 66438345
4-(bromomethyl)-1,5-dipropylpyrazole
CID 66437945
1-[2-(dimethylamino)ethyl]-5-N-ethylpyrazole-4,5-diamine
CID 58914028
1-[4-chloro-1-[2-(dimethylamino)ethyl]pyrazol-5-yl]pentan-3-amine
CID 114663857
2-(5-chloro-3-propylpyrazol-1-yl)-N,N-dimethylethanamine
CID 66022661
N-[[4-(aminomethyl)-1-methylpyrazol-5-yl]methyl]-N-methylethanamine
CID 165448322
1-[4-bromo-1-[2-(dimethylamino)ethyl]pyrazol-5-yl]hexan-3-ol
CID 114664927
[5-propyl-1-(2,4,5-trifluorophenyl)pyrazol-4-yl]methanamine
CID 66441619

Frequently Asked Questions

What is the IUPAC name of 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine?
The IUPAC name of 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine (CID 66441376) is 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine?
The canonical SMILES for 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine is CCCc1c(CN)cnn1CCN(C)C.
What is the InChIKey of 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine?
The InChIKey is HZEGSZFSXQHVRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-4-5-11-10(8-12)9-13-15(11)7-6-14(2)3/h9H,4-8,12H2,1-3H3.
What are the key properties of 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine?
2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine has a molecular weight of 210.32 g/mol, XLogP of 0.86, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 66441376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).