N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine

C11H21N3 — CID 43492399

IUPACN-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine
SMILESCCNC(c1cnn(C)c1)C(C)(C)C
InChIInChI=1S/C11H21N3/c1-6-12-10(11(2,3)4)9-7-13-14(5)8-9/h7-8,10,12H,6H2,1-5H3
InChIKeyKYTQBMHLMABMFL-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.12
Rot. Bonds3

About N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine

N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine (PubChem CID 43492399) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine
PubChem CID43492399
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC NameN-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine
SMILESCCNC(c1cnn(C)c1)C(C)(C)C
InChIInChI=1S/C11H21N3/c1-6-12-10(11(2,3)4)9-7-13-14(5)8-9/h7-8,10,12H,6H2,1-5H3
InChIKeyKYTQBMHLMABMFL-UHFFFAOYSA-N
XLogP2.12
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)butan-1-amine
CID 115808764
2,2-dimethyl-1-(1-methylpyrazol-4-yl)-N-propylpropan-1-amine
CID 43497251
2-(azepan-1-yl)-N-ethyl-2-methyl-1-(1-methylpyrazol-4-yl)propan-1-amine
CID 79051106
N-ethyl-1-(1-methylpyrazol-4-yl)ethanamine
CID 43492401
N-[2,2,2-trifluoro-1-(1-methylpyrazol-4-yl)ethyl]propan-1-amine
CID 43497243
N-ethyl-3-methyl-1-(1-methylpyrazol-4-yl)-2-propan-2-ylbutan-1-amine
CID 114282093
N-ethyl-4,4-dimethyl-1-(1-methylpyrazol-4-yl)pentan-1-amine
CID 65195392
N-[(2,5-dimethyl-1H-imidazol-4-yl)methyl]-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine
CID 167929138
2-(ethylamino)-2-(1-methylpyrazol-4-yl)acetonitrile
CID 43115049
N-[(1-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
CID 115808792
(2S)-2-(ethylamino)-2-(1-methylpyrazol-4-yl)acetic acid
CID 93280089
N,N-diethyl-1-hydrazinyl-2-methyl-1-(1-methylpyrazol-4-yl)propan-2-amine
CID 105239216

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine?
The IUPAC name of N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine (CID 43492399) is N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine?
The canonical SMILES for N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine is CCNC(c1cnn(C)c1)C(C)(C)C.
What is the InChIKey of N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine?
The InChIKey is KYTQBMHLMABMFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-6-12-10(11(2,3)4)9-7-13-14(5)8-9/h7-8,10,12H,6H2,1-5H3.
What are the key properties of N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine?
N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine has a molecular weight of 195.31 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethyl-1-(1-methylpyrazol-4-yl)propan-1-amine is sourced from PubChem (CID 43492399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).