N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine

C11H20N4 — CID 66216526

IUPACN-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine
SMILESCCCN(CCn1cccn1)C1CNC1
InChIInChI=1S/C11H20N4/c1-2-5-14(11-9-12-10-11)7-8-15-6-3-4-13-15/h3-4,6,11-12H,2,5,7-10H2,1H3
InChIKeyKUUOYYQWWYAGRD-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.57
Rot. Bonds6

About N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine

N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine (PubChem CID 66216526) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine.

Molecular Properties

Compound NameN-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine
PubChem CID66216526
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC NameN-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine
SMILESCCCN(CCn1cccn1)C1CNC1
InChIInChI=1S/C11H20N4/c1-2-5-14(11-9-12-10-11)7-8-15-6-3-4-13-15/h3-4,6,11-12H,2,5,7-10H2,1H3
InChIKeyKUUOYYQWWYAGRD-UHFFFAOYSA-N
XLogP0.57
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-propyl-N-(2-pyrazol-1-ylethyl)piperidin-3-amine
CID 63636647
N-propyl-N-(2-pyrazol-1-ylethyl)piperidin-4-amine
CID 54960820
N-(azetidin-3-yl)-N-propyl-3-pyrazol-1-ylpropanamide
CID 66182453
4-N-ethyl-4-N-(2-pyrazol-1-ylethyl)cyclohexane-1,4-diamine
CID 79115977
N-propyl-N-[2-(1,2,4-triazol-1-yl)ethyl]pyrrolidin-3-amine;dihydrochloride
CID 119921495
3-[azetidin-3-yl(propyl)amino]propan-1-ol
CID 66215108
N-(2-morpholin-4-ylethyl)-N-propylazetidin-3-amine
CID 66215890
2-pyrazol-1-yl-N,N-bis(2-pyrazol-1-ylethyl)ethanamine
CID 5255415
N-(3-methylbutyl)-N-propylazetidin-3-amine
CID 66182647
N-ethyl-N-[2-(2-methylimidazol-1-yl)ethyl]azetidin-3-amine
CID 66183472
N'-propyl-N'-(2-pyrazol-1-ylethyl)ethane-1,2-diamine
CID 61492014
N-ethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine
CID 103005268

Frequently Asked Questions

What is the IUPAC name of N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine?
The IUPAC name of N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine (CID 66216526) is N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine.
What is the SMILES notation for N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine?
The canonical SMILES for N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine is CCCN(CCn1cccn1)C1CNC1.
What is the InChIKey of N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine?
The InChIKey is KUUOYYQWWYAGRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-2-5-14(11-9-12-10-11)7-8-15-6-3-4-13-15/h3-4,6,11-12H,2,5,7-10H2,1H3.
What are the key properties of N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine?
N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine has a molecular weight of 208.31 g/mol, XLogP of 0.57, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-(2-pyrazol-1-ylethyl)azetidin-3-amine is sourced from PubChem (CID 66216526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).