4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine

C17H24N4 — CID 43281591

IUPAC4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine
SMILESCCN(C)c1c(CNC2CC2)c(C)nn1-c1ccccc1
InChIInChI=1S/C17H24N4/c1-4-20(3)17-16(12-18-14-10-11-14)13(2)19-21(17)15-8-6-5-7-9-15/h5-9,14,18H,4,10-12H2,1-3H3
InChIKeyKFGTZUBRWKOQOG-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.89
Rot. Bonds6

About 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine

4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine (PubChem CID 43281591) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine.

Molecular Properties

Compound Name4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine
PubChem CID43281591
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine
SMILESCCN(C)c1c(CNC2CC2)c(C)nn1-c1ccccc1
InChIInChI=1S/C17H24N4/c1-4-20(3)17-16(12-18-14-10-11-14)13(2)19-21(17)15-8-6-5-7-9-15/h5-9,14,18H,4,10-12H2,1-3H3
InChIKeyKFGTZUBRWKOQOG-UHFFFAOYSA-N
XLogP2.89
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-[ethyl(methyl)amino]-3-methyl-1-phenylpyrazol-4-yl]methanol
CID 43263588
4-(ethylaminomethyl)-N,3-dimethyl-1-phenyl-N-propan-2-ylpyrazol-5-amine
CID 43280900
4-[(cyclopropylamino)methyl]-N,N-diethyl-1,3-dimethylpyrazol-5-amine
CID 43280325
N-butyl-4-[(cyclopropylamino)methyl]-N,1,3-trimethylpyrazol-5-amine
CID 43280696
4-[(cyclopropylamino)methyl]-N-(furan-2-ylmethyl)-N,1,3-trimethylpyrazol-5-amine
CID 43527108
N-[(3,5-dimethyl-1-pyrimidin-2-ylpyrazol-4-yl)methyl]cyclopropanamine
CID 61272914
4-[(cyclopropylamino)methyl]-N,1,3-trimethyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazol-5-amine
CID 61442546
5-[cyclopropylmethyl(methyl)amino]-3-methyl-1-phenylpyrazole-4-carbaldehyde
CID 60984635
4-(chloromethyl)-N-(cyclopropylmethyl)-N-ethyl-3-methyl-1-phenylpyrazol-5-amine
CID 63954999
4-(2-aminoethyl)-N-(2-methoxyethyl)-N,3-dimethyl-1-phenylpyrazol-5-amine
CID 63785720
4-(bromomethyl)-N-(1-cyclopropylethyl)-N,3-dimethyl-1-phenylpyrazol-5-amine
CID 107080390
4-[[5-chloro-1-(3-chlorophenyl)-3-methylpyrazol-4-yl]methylamino]cyclohexan-1-ol
CID 78809954

Frequently Asked Questions

What is the IUPAC name of 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine?
The IUPAC name of 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine (CID 43281591) is 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine.
What is the SMILES notation for 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine?
The canonical SMILES for 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine is CCN(C)c1c(CNC2CC2)c(C)nn1-c1ccccc1.
What is the InChIKey of 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine?
The InChIKey is KFGTZUBRWKOQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-4-20(3)17-16(12-18-14-10-11-14)13(2)19-21(17)15-8-6-5-7-9-15/h5-9,14,18H,4,10-12H2,1-3H3.
What are the key properties of 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine?
4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine has a molecular weight of 284.41 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(cyclopropylamino)methyl]-N-ethyl-N,3-dimethyl-1-phenylpyrazol-5-amine is sourced from PubChem (CID 43281591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).