N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine

C15H22N4S — CID 61448745

IUPACN-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine
SMILESCNCc1c(C)nn(C)c1N(Cc1cccs1)C1CC1
InChIInChI=1S/C15H22N4S/c1-11-14(9-16-2)15(18(3)17-11)19(12-6-7-12)10-13-5-4-8-20-13/h4-5,8,12,16H,6-7,9-10H2,1-3H3
InChIKeyUHFOQSREMBSKLO-UHFFFAOYSA-N
MW290.44 g/mol
LogP2.68
Rot. Bonds6

About N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine

N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine (PubChem CID 61448745) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine.

Molecular Properties

Compound NameN-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine
PubChem CID61448745
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC NameN-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine
SMILESCNCc1c(C)nn(C)c1N(Cc1cccs1)C1CC1
InChIInChI=1S/C15H22N4S/c1-11-14(9-16-2)15(18(3)17-11)19(12-6-7-12)10-13-5-4-8-20-13/h4-5,8,12,16H,6-7,9-10H2,1-3H3
InChIKeyUHFOQSREMBSKLO-UHFFFAOYSA-N
XLogP2.68
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(aminomethyl)-N-cyclopropyl-1,3-dimethyl-N-(thiophen-2-ylmethyl)pyrazol-5-amine
CID 61449188
4-[(tert-butylamino)methyl]-N,1,3-trimethyl-N-(thiophen-2-ylmethyl)pyrazol-5-amine
CID 63060030
4-[[cyclopropyl(thiophen-2-ylmethyl)amino]methyl]-1,3-dimethylpyrazol-5-amine
CID 55046428
N-cyclopropyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 105073669
2-[cyclobutyl-[1,3-dimethyl-4-(methylaminomethyl)pyrazol-5-yl]amino]ethanol
CID 102864919
N,1,3-trimethyl-4-[(propan-2-ylamino)methyl]-N-(2-thiophen-2-ylethyl)pyrazol-5-amine
CID 79488921
2-chloro-N-cyclopropyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)aniline
CID 81148558
N-cyclopropyl-3-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 81247478
4-(chloromethyl)-N-ethyl-1,3-dimethyl-N-(thiophen-2-ylmethyl)pyrazol-5-amine
CID 61437184
5-chloro-N-cyclopropyl-6-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 62288900
4-(bromomethyl)-1,3-dimethyl-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrazol-5-amine
CID 107081607
N,1,3-trimethyl-4-(methylaminomethyl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrazol-5-amine
CID 55259433

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine?
The IUPAC name of N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine (CID 61448745) is N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine.
What is the SMILES notation for N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine?
The canonical SMILES for N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine is CNCc1c(C)nn(C)c1N(Cc1cccs1)C1CC1.
What is the InChIKey of N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine?
The InChIKey is UHFOQSREMBSKLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4S/c1-11-14(9-16-2)15(18(3)17-11)19(12-6-7-12)10-13-5-4-8-20-13/h4-5,8,12,16H,6-7,9-10H2,1-3H3.
What are the key properties of N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine?
N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine has a molecular weight of 290.44 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1,3-dimethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazol-5-amine is sourced from PubChem (CID 61448745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).