N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine

C15H30N4 — CID 66440973

IUPACN-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine
SMILESCCCc1c(CNC(C)(C)C)cnn1CCN(C)C
InChIInChI=1S/C15H30N4/c1-7-8-14-13(11-16-15(2,3)4)12-17-19(14)10-9-18(5)6/h12,16H,7-11H2,1-6H3
InChIKeyIMFXZAXMMSHBRX-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.29
Rot. Bonds7

About N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine

N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine (PubChem CID 66440973) has the molecular formula C15H30N4 and a molecular weight of 266.43 g/mol. Its IUPAC name is N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine
PubChem CID66440973
Molecular FormulaC15H30N4
Molecular Weight266.43 g/mol
Exact Mass266.25
IUPAC NameN-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine
SMILESCCCc1c(CNC(C)(C)C)cnn1CCN(C)C
InChIInChI=1S/C15H30N4/c1-7-8-14-13(11-16-15(2,3)4)12-17-19(14)10-9-18(5)6/h12,16H,7-11H2,1-6H3
InChIKeyIMFXZAXMMSHBRX-UHFFFAOYSA-N
XLogP2.29
TPSA33.09 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 ≤ 52.29
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-1-amine
CID 66441173
2-[4-(aminomethyl)-5-propylpyrazol-1-yl]-N,N-dimethylethanamine
CID 66441376
2-methyl-N-[(1-pentan-3-yl-5-propylpyrazol-4-yl)methyl]propan-2-amine
CID 66441955
[1-[2-(dimethylamino)ethyl]-5-ethylpyrazol-4-yl]methanol
CID 66438345
N-[(1-cycloheptyl-5-ethylpyrazol-4-yl)methyl]-2-methylpropan-2-amine
CID 66441750
1-[2-(dimethylamino)ethyl]-5-N-ethylpyrazole-4,5-diamine
CID 58914028
4-(bromomethyl)-1,5-dipropylpyrazole
CID 66437945
N-[(4-methoxy-1-propylpyrazol-5-yl)methyl]-2-methylpropan-2-amine
CID 114652183
N-[[5-(difluoromethyl)-1-ethylpyrazol-4-yl]methyl]-2-methylpropan-2-amine
CID 66441934
2-[2-(dimethylamino)ethyl]-5-(ethylamino)pyridazin-3-one
CID 103219051
2-[4-bromo-5-(methylaminomethyl)pyrazol-1-yl]-N,N-dimethylethanamine
CID 114652050
2-methyl-N-[[1-(3-methylbutyl)-5-propan-2-ylpyrazol-4-yl]methyl]propan-2-amine
CID 66442365

Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine (CID 66440973) is N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine is CCCc1c(CNC(C)(C)C)cnn1CCN(C)C.
What is the InChIKey of N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is IMFXZAXMMSHBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4/c1-7-8-14-13(11-16-15(2,3)4)12-17-19(14)10-9-18(5)6/h12,16H,7-11H2,1-6H3.
What are the key properties of N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine?
N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 266.43 g/mol, XLogP of 2.29, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(dimethylamino)ethyl]-5-propylpyrazol-4-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 66440973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).