N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine

C14H23N3 — CID 43751954

IUPACN-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine
SMILESCc1c(C(C)NC(C2CC2)C2CC2)cnn1C
InChIInChI=1S/C14H23N3/c1-9(13-8-15-17(3)10(13)2)16-14(11-4-5-11)12-6-7-12/h8-9,11-12,14,16H,4-7H2,1-3H3
InChIKeyMEQZRMGUOSWATR-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.57
Rot. Bonds5

About N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine

N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine (PubChem CID 43751954) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine
PubChem CID43751954
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC NameN-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine
SMILESCc1c(C(C)NC(C2CC2)C2CC2)cnn1C
InChIInChI=1S/C14H23N3/c1-9(13-8-15-17(3)10(13)2)16-14(11-4-5-11)12-6-7-12/h8-9,11-12,14,16H,4-7H2,1-3H3
InChIKeyMEQZRMGUOSWATR-UHFFFAOYSA-N
XLogP2.57
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-3-methylbutan-2-amine
CID 43751933
1-(1,5-dimethylpyrazol-4-yl)-N-methylethanamine
CID 23005795
N-(dicyclopropylmethyl)-1-(1,3-dimethylpyrazol-4-yl)ethanamine
CID 65191955
1-(2-bicyclo[2.2.1]hept-5-enyl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine
CID 43792498
1-(1,5-dimethylpyrazol-4-yl)-N-[1-(2,4,6-trimethylphenyl)ethyl]ethanamine
CID 43751968
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-1,1-dioxothian-4-amine
CID 43752008
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-1-(2,5-dimethylthiophen-3-yl)ethanamine
CID 43751841
1-(2-bromophenyl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]ethanamine
CID 43751951
1-(4-chlorophenyl)-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]propan-2-amine
CID 103910362
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]azepan-4-amine
CID 103981520
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-1-(5-methylthiophen-2-yl)ethanamine
CID 43751923
N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-4-propylcyclohexan-1-amine
CID 43435522

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine?
The IUPAC name of N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine (CID 43751954) is N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine.
What is the SMILES notation for N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine?
The canonical SMILES for N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine is Cc1c(C(C)NC(C2CC2)C2CC2)cnn1C.
What is the InChIKey of N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine?
The InChIKey is MEQZRMGUOSWATR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-9(13-8-15-17(3)10(13)2)16-14(11-4-5-11)12-6-7-12/h8-9,11-12,14,16H,4-7H2,1-3H3.
What are the key properties of N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine?
N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine has a molecular weight of 233.36 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-1-(1,5-dimethylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 43751954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).