2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline

C17H21N3O — CID 43717239

IUPAC2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline
SMILESCC(Nc1ccccc1N1CCOCC1)c1ccncc1
InChIInChI=1S/C17H21N3O/c1-14(15-6-8-18-9-7-15)19-16-4-2-3-5-17(16)20-10-12-21-13-11-20/h2-9,14,19H,10-13H2,1H3
InChIKeyQPRMLNMKCNDJKR-UHFFFAOYSA-N
MW283.38 g/mol
LogP3.09
Rot. Bonds4

About 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline

2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline (PubChem CID 43717239) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline
PubChem CID43717239
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline
SMILESCC(Nc1ccccc1N1CCOCC1)c1ccncc1
InChIInChI=1S/C17H21N3O/c1-14(15-6-8-18-9-7-15)19-16-4-2-3-5-17(16)20-10-12-21-13-11-20/h2-9,14,19H,10-13H2,1H3
InChIKeyQPRMLNMKCNDJKR-UHFFFAOYSA-N
XLogP3.09
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-morpholin-4-yl-N-[1-(1,3-thiazol-4-yl)ethyl]aniline
CID 115925823
N-(1-cyclopropylethyl)-2-morpholin-4-ylaniline
CID 43717242
N-[1-(1-methylcyclopropyl)ethyl]-2-morpholin-4-ylaniline
CID 43717227
2-morpholin-4-yl-N-(pyridin-4-ylmethyl)aniline
CID 43229589
6-morpholin-4-yl-N-(1-pyridin-4-ylethyl)pyridin-3-amine
CID 43724774
6-morpholin-4-yl-N-[(1R)-1-pyridin-4-ylethyl]pyrimidin-4-amine
CID 124626033
4-N-(2-morpholin-4-ylphenyl)-2-N-propan-2-ylpyrimidine-2,4-diamine
CID 112882201
2-chloro-N-(1-pyridin-4-ylethyl)aniline
CID 43194712
2-methyl-N-(2-morpholin-4-ylphenyl)propanamide
CID 2767049
3-[1-(2-pyrrolidin-1-ylanilino)ethyl]phenol
CID 43684258
2-bromo-N-(2-morpholin-4-ylphenyl)propanamide
CID 107903089
2-amino-N-(2-morpholin-4-ylphenyl)propanethioamide
CID 88902286

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline?
The IUPAC name of 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline (CID 43717239) is 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline.
What is the SMILES notation for 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline?
The canonical SMILES for 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline is CC(Nc1ccccc1N1CCOCC1)c1ccncc1.
What is the InChIKey of 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline?
The InChIKey is QPRMLNMKCNDJKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-14(15-6-8-18-9-7-15)19-16-4-2-3-5-17(16)20-10-12-21-13-11-20/h2-9,14,19H,10-13H2,1H3.
What are the key properties of 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline?
2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline has a molecular weight of 283.38 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(1-pyridin-4-ylethyl)aniline is sourced from PubChem (CID 43717239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).