N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine

C19H23F2N3O2 — CID 171359963

IUPACN-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine
SMILESCc1nc(N2CCOCC2)ccc1N[C@@H](C)c1ccccc1OC(F)F
InChIInChI=1S/C19H23F2N3O2/c1-13(15-5-3-4-6-17(15)26-19(20)21)22-16-7-8-18(23-14(16)2)24-9-11-25-12-10-24/h3-8,13,19,22H,9-12H2,1-2H3/t13-/m0/s1
InChIKeyUDIYLLVDHGNJQE-ZDUSSCGKSA-N
MW363.41 g/mol
LogP4.00
Rot. Bonds6

About N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine

N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine (PubChem CID 171359963) has the molecular formula C19H23F2N3O2 and a molecular weight of 363.41 g/mol. Its IUPAC name is N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine
PubChem CID171359963
Molecular FormulaC19H23F2N3O2
Molecular Weight363.41 g/mol
Exact Mass363.18
IUPAC NameN-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine
SMILESCc1nc(N2CCOCC2)ccc1N[C@@H](C)c1ccccc1OC(F)F
InChIInChI=1S/C19H23F2N3O2/c1-13(15-5-3-4-6-17(15)26-19(20)21)22-16-7-8-18(23-14(16)2)24-9-11-25-12-10-24/h3-8,13,19,22H,9-12H2,1-2H3/t13-/m0/s1
InChIKeyUDIYLLVDHGNJQE-ZDUSSCGKSA-N
XLogP4.00
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.41
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-ethylpropyl)-(3-methoxy-5-(2-methoxy-4-trifluoromethoxyphenyl)-6-methyl-pyrazin-2-yl)amine
CID 9822241
6-{[(3s,4s)-4-{2-[(2-Methoxybenzyl)amino]ethoxy}pyrrolidin-3-Yl]methyl}-4-Methylpyridin-2-Amine
CID 56835762
4-[4-(2-Methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]morpholine
CID 2989573
3,6-diethyl-5-(2-methoxy-4-methylphenyl)-N-pentan-3-ylpyrazin-2-amine
CID 9945957
3,6-diethyl-5-[2-methoxy-4-(trifluoromethyl)phenyl]-N-pentan-3-ylpyrazin-2-amine
CID 10178818
3,6-diethyl-5-[4-methoxy-2-(trifluoromethoxy)phenyl]-N-pentan-3-ylpyrazin-2-amine
CID 10223332
3-ethyl-6-methoxy-5-[2-methoxy-4-(trifluoromethoxy)phenyl]-N-pentan-3-ylpyrazin-2-amine
CID 10295219
2-methoxy-N-[2-(4-methoxyphenyl)ethyl]-6-(4-morpholin-4-ylphenyl)pyrimidin-4-amine
CID 11502665
6-ethyl-3-methoxy-5-[2-methoxy-4-(trifluoromethyl)phenyl]-N-pentan-3-ylpyrazin-2-amine
CID 22248884
5-(2,6-dimethoxy-3-pyridinyl)-3,6-diethyl-N-pentan-3-ylpyrazin-2-amine
CID 22249041
6-ethyl-3-methoxy-5-[4-methoxy-2-(trifluoromethyl)phenyl]-N-pentan-3-ylpyrazin-2-amine
CID 22249054
3-methoxy-5-[2-methoxy-4-(trifluoromethyl)phenyl]-6-methyl-N-pentan-3-ylpyrazin-2-amine
CID 23595046

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine?
The IUPAC name of N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine (CID 171359963) is N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine.
What is the SMILES notation for N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine?
The canonical SMILES for N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine is Cc1nc(N2CCOCC2)ccc1N[C@@H](C)c1ccccc1OC(F)F.
What is the InChIKey of N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine?
The InChIKey is UDIYLLVDHGNJQE-ZDUSSCGKSA-N. The full InChI is InChI=1S/C19H23F2N3O2/c1-13(15-5-3-4-6-17(15)26-19(20)21)22-16-7-8-18(23-14(16)2)24-9-11-25-12-10-24/h3-8,13,19,22H,9-12H2,1-2H3/t13-/m0/s1.
What are the key properties of N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine?
N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine has a molecular weight of 363.41 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-[2-(difluoromethoxy)phenyl]ethyl]-2-methyl-6-morpholin-4-ylpyridin-3-amine is sourced from PubChem (CID 171359963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).