N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine

C12H23N3 — CID 43791834

IUPACN-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine
SMILESCCCCC(C)NC(C)Cn1cccn1
InChIInChI=1S/C12H23N3/c1-4-5-7-11(2)14-12(3)10-15-9-6-8-13-15/h6,8-9,11-12,14H,4-5,7,10H2,1-3H3
InChIKeyUFRWULREVNUKKK-UHFFFAOYSA-N
MW209.34 g/mol
LogP2.44
Rot. Bonds7

About N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine

N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine (PubChem CID 43791834) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine.

Molecular Properties

Compound NameN-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine
PubChem CID43791834
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC NameN-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine
SMILESCCCCC(C)NC(C)Cn1cccn1
InChIInChI=1S/C12H23N3/c1-4-5-7-11(2)14-12(3)10-15-9-6-8-13-15/h6,8-9,11-12,14H,4-5,7,10H2,1-3H3
InChIKeyUFRWULREVNUKKK-UHFFFAOYSA-N
XLogP2.44
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-pyrazol-1-ylpropan-2-amine
CID 43435880
(2S)-2-(4-pyrazol-1-ylbutan-2-ylamino)propan-1-ol
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(1R)-1-phenyl-N-[(2S)-1-pyrazol-1-ylpropan-2-yl]propan-1-amine
CID 93276656
1-pyrazol-1-ylpropan-2-ylcyanamide
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N-(3-pyrazol-1-ylpropyl)octan-2-amine
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CID 80601447
N-[4-(1,2,4-triazol-1-yl)butan-2-yl]hexan-2-amine
CID 115726756
N-(4-pyrazol-1-ylbutan-2-yl)pentan-1-amine
CID 115976552
N-hexan-2-ylpyrrol-1-amine
CID 79090686
4-[1-(1-pyrazol-1-ylpropan-2-ylamino)propyl]phenol
CID 43749270
1-heptan-2-yl-2-methyl-3-(2-methyl-3-pyrazol-1-ylpropyl)guanidine;hydroiodide
CID 111195875
1-[2-(imidazol-1-ylmethyl)hexyl]pyrazole
CID 57057005

Frequently Asked Questions

What is the IUPAC name of N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine?
The IUPAC name of N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine (CID 43791834) is N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine.
What is the SMILES notation for N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine?
The canonical SMILES for N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine is CCCCC(C)NC(C)Cn1cccn1.
What is the InChIKey of N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine?
The InChIKey is UFRWULREVNUKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-4-5-7-11(2)14-12(3)10-15-9-6-8-13-15/h6,8-9,11-12,14H,4-5,7,10H2,1-3H3.
What are the key properties of N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine?
N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine has a molecular weight of 209.34 g/mol, XLogP of 2.44, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-pyrazol-1-ylpropan-2-yl)hexan-2-amine is sourced from PubChem (CID 43791834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).