N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine

C11H22N4 — CID 103131264

IUPACN-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine
SMILESCCNC(CCN(C)C)c1ccn(C)n1
InChIInChI=1S/C11H22N4/c1-5-12-10(6-8-14(2)3)11-7-9-15(4)13-11/h7,9-10,12H,5-6,8H2,1-4H3
InChIKeyVGQALPNHSVVMSZ-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.02
Rot. Bonds6

About N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine

N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine (PubChem CID 103131264) has the molecular formula C11H22N4 and a molecular weight of 210.32 g/mol. Its IUPAC name is N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine.

Molecular Properties

Compound NameN-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine
PubChem CID103131264
Molecular FormulaC11H22N4
Molecular Weight210.32 g/mol
Exact Mass210.18
IUPAC NameN-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine
SMILESCCNC(CCN(C)C)c1ccn(C)n1
InChIInChI=1S/C11H22N4/c1-5-12-10(6-8-14(2)3)11-7-9-15(4)13-11/h7,9-10,12H,5-6,8H2,1-4H3
InChIKeyVGQALPNHSVVMSZ-UHFFFAOYSA-N
XLogP1.02
TPSA33.09 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 ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydrazinyl-N,N-dimethyl-3-(1-methylpyrazol-3-yl)propan-1-amine
CID 103140522
N-ethyl-1-(1-methylpyrazol-3-yl)-3-propoxypropan-1-amine
CID 103134564
N-ethyl-1,2-bis(1-methylpyrazol-3-yl)ethanamine
CID 82878256
N-ethyl-2-ethylsulfanyl-1-(1-methylpyrazol-3-yl)ethanamine
CID 103130891
N-ethyl-1-(1-methylpyrazol-3-yl)pent-3-yn-1-amine
CID 65200857
N,N',N'-trimethyl-1-(1-methylpyrazol-3-yl)ethane-1,2-diamine
CID 103131116
N-ethyl-2-(4-iodophenyl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 65479181
2-(2,6-dichlorophenyl)-N-ethyl-1-(1-methylpyrazol-3-yl)ethanamine
CID 65200586
N-ethyl-2-(2-methylphenyl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 65200329
2-(2-bromophenyl)-N-ethyl-1-(1-methylpyrazol-3-yl)ethanamine
CID 65200168
N-ethyl-N',N'-dimethyl-1-pyrazin-2-ylpropane-1,3-diamine
CID 115346569
1-[ethylamino-(1-methylpyrazol-3-yl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 103131095

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine?
The IUPAC name of N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine (CID 103131264) is N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine.
What is the SMILES notation for N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine?
The canonical SMILES for N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine is CCNC(CCN(C)C)c1ccn(C)n1.
What is the InChIKey of N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine?
The InChIKey is VGQALPNHSVVMSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4/c1-5-12-10(6-8-14(2)3)11-7-9-15(4)13-11/h7,9-10,12H,5-6,8H2,1-4H3.
What are the key properties of N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine?
N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine has a molecular weight of 210.32 g/mol, XLogP of 1.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N',N'-dimethyl-1-(1-methylpyrazol-3-yl)propane-1,3-diamine is sourced from PubChem (CID 103131264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).