1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine

C11H21N3 — CID 150443374

IUPAC1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine
SMILESCc1c(CN(C)C)nn(C(C)C)c1C
InChIInChI=1S/C11H21N3/c1-8(2)14-10(4)9(3)11(12-14)7-13(5)6/h8H,7H2,1-6H3
InChIKeyHMFYSTHJCXPNBE-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.14
Rot. Bonds3

About 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine

1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine (PubChem CID 150443374) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine
PubChem CID150443374
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine
SMILESCc1c(CN(C)C)nn(C(C)C)c1C
InChIInChI=1S/C11H21N3/c1-8(2)14-10(4)9(3)11(12-14)7-13(5)6/h8H,7H2,1-6H3
InChIKeyHMFYSTHJCXPNBE-UHFFFAOYSA-N
XLogP2.14
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;3-ethyl-5-methyl-1-propan-2-ylpyrazol-4-amine
CID 156792933
4-(1-chloroethyl)-3,5-dimethyl-1-propan-2-ylpyrazole
CID 62729832
4-fluoro-3,5-dimethyl-1-propan-2-ylpyrazole
CID 134417435
3,5-diethyl-4-(2,3,4,5,6-pentamethylphenyl)-1-propan-2-ylpyrazole
CID 153416742
2-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)propan-2-ol
CID 115020800
3,5-diethyl-4-(2,3,4,5,6-pentamethylphenyl)-1-propan-2-ylpyrazole;platinum
CID 153416741
1-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-N-methylpropan-1-amine
CID 62730290
2-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)ethanamine
CID 23005875
N,N-dimethylethanamine;2-methylpropane
CID 145274023
2-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)propanoic acid
CID 23005851
N,N-dimethyl-1-(1-methyl-5-propan-2-ylpyrazol-3-yl)methanamine
CID 176992334
1-benzyl-3-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-1-methylurea
CID 60611272

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine (CID 150443374) is 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine is Cc1c(CN(C)C)nn(C(C)C)c1C.
What is the InChIKey of 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine?
The InChIKey is HMFYSTHJCXPNBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-8(2)14-10(4)9(3)11(12-14)7-13(5)6/h8H,7H2,1-6H3.
What are the key properties of 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine?
1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine has a molecular weight of 195.31 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethyl-1-propan-2-ylpyrazol-3-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 150443374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).