N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine

C12H19N3 — CID 66183855

IUPACN-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine
SMILESCCN(CCc1ccncc1)C1CNC1
InChIInChI=1S/C12H19N3/c1-2-15(12-9-14-10-12)8-5-11-3-6-13-7-4-11/h3-4,6-7,12,14H,2,5,8-10H2,1H3
InChIKeyKDSZAVVXBHPKKF-UHFFFAOYSA-N
MW205.31 g/mol
LogP0.92
Rot. Bonds5

About N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine

N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine (PubChem CID 66183855) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine.

Molecular Properties

Compound NameN-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine
PubChem CID66183855
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine
SMILESCCN(CCc1ccncc1)C1CNC1
InChIInChI=1S/C12H19N3/c1-2-15(12-9-14-10-12)8-5-11-3-6-13-7-4-11/h3-4,6-7,12,14H,2,5,8-10H2,1H3
InChIKeyKDSZAVVXBHPKKF-UHFFFAOYSA-N
XLogP0.92
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(2-phenylethyl)azetidin-3-amine
CID 66182276
N-ethyl-N-(pyridin-4-ylmethyl)azetidin-3-amine;trihydrochloride
CID 146064325
N-ethyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine
CID 103005268
N-methyl-N-(pyridin-4-ylmethyl)azetidin-3-amine
CID 62786509
2-(azetidin-3-yl)-N-methyl-N-(2-pyridin-4-ylethyl)ethanamine
CID 116679477
N-methyl-4-methylsulfanyl-N-(2-pyridin-4-ylethyl)pyrrolidin-3-amine
CID 82760083
N'-cyclopropyl-N'-(2-pyridin-4-ylethyl)ethane-1,2-diamine
CID 61349557
2-[cyclopropyl(2-pyridin-4-ylethyl)amino]ethanol
CID 60774994
N-methyl-N-[(4-methylpyrrolidin-3-yl)methyl]-2-pyridin-4-ylethanamine
CID 55229589
N-methyl-N-[2-(4-propylphenyl)ethyl]azetidin-3-amine
CID 117040771
N-ethyl-N-[2-(2-methylimidazol-1-yl)ethyl]azetidin-3-amine
CID 66183472
N-ethyl-N-(1-pyridin-4-ylethyl)azetidin-3-amine
CID 66181652

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine?
The IUPAC name of N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine (CID 66183855) is N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine.
What is the SMILES notation for N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine?
The canonical SMILES for N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine is CCN(CCc1ccncc1)C1CNC1.
What is the InChIKey of N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine?
The InChIKey is KDSZAVVXBHPKKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-2-15(12-9-14-10-12)8-5-11-3-6-13-7-4-11/h3-4,6-7,12,14H,2,5,8-10H2,1H3.
What are the key properties of N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine?
N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine has a molecular weight of 205.31 g/mol, XLogP of 0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-pyridin-4-ylethyl)azetidin-3-amine is sourced from PubChem (CID 66183855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).