N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine

C13H25N3 — CID 105176670

IUPACN,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine
SMILESCCNC(CC(CC)CC)c1ccnn1C
InChIInChI=1S/C13H25N3/c1-5-11(6-2)10-12(14-7-3)13-8-9-15-16(13)4/h8-9,11-12,14H,5-7,10H2,1-4H3
InChIKeySAZVQIAPQBHSPW-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.90
Rot. Bonds7

About N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine

N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine (PubChem CID 105176670) has the molecular formula C13H25N3 and a molecular weight of 223.36 g/mol. Its IUPAC name is N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine.

Molecular Properties

Compound NameN,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine
PubChem CID105176670
Molecular FormulaC13H25N3
Molecular Weight223.36 g/mol
Exact Mass223.20
IUPAC NameN,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine
SMILESCCNC(CC(CC)CC)c1ccnn1C
InChIInChI=1S/C13H25N3/c1-5-11(6-2)10-12(14-7-3)13-8-9-15-16(13)4/h8-9,11-12,14H,5-7,10H2,1-4H3
InChIKeySAZVQIAPQBHSPW-UHFFFAOYSA-N
XLogP2.90
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-1-(2-methylpyrazol-3-yl)pentan-1-ol
CID 114554038
N-ethyl-3-methylidene-1-(2-methylpyrazol-3-yl)pentan-1-amine
CID 105163864
1-(2-methylpyrazol-3-yl)propylhydrazine
CID 105200909
2-ethyl-N-[1-(2-methylpyrazol-3-yl)ethyl]butan-1-amine
CID 106758131
N-ethyl-2-methyl-1-(2-methylpyrazol-3-yl)propan-1-amine
CID 63962680
2-(3,4-dimethylphenyl)-N-ethyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 63963537
2-[[(1S)-1-(2-methylpyrazol-3-yl)propyl]amino]propane-1,3-diol
CID 95121354
N-ethyl-3-methyl-1-(2-propylpyrazol-3-yl)butan-1-amine
CID 63976154
N-ethyl-1-(2-methylpyrazol-3-yl)-2-quinolin-4-ylethanamine
CID 105159264
N-ethyl-3-methyl-1-(2-phenylpyrazol-3-yl)butan-1-amine
CID 107330516
N-ethyl-2-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]-1-(2-methylpyrazol-3-yl)ethanamine
CID 105160734
2-(2-chloro-6-fluorophenyl)-N-ethyl-1-(2-methylpyrazol-3-yl)ethanamine
CID 63962445

Frequently Asked Questions

What is the IUPAC name of N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine?
The IUPAC name of N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine (CID 105176670) is N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine.
What is the SMILES notation for N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine?
The canonical SMILES for N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine is CCNC(CC(CC)CC)c1ccnn1C.
What is the InChIKey of N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine?
The InChIKey is SAZVQIAPQBHSPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3/c1-5-11(6-2)10-12(14-7-3)13-8-9-15-16(13)4/h8-9,11-12,14H,5-7,10H2,1-4H3.
What are the key properties of N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine?
N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine has a molecular weight of 223.36 g/mol, XLogP of 2.90, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-diethyl-1-(2-methylpyrazol-3-yl)pentan-1-amine is sourced from PubChem (CID 105176670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).