N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine

C22H23N3O — CID 24954444

IUPACN-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine
SMILESc1ccc(Nc2ccc(CN3CCO[C@@H](c4ccccc4)C3)cn2)cc1
InChIInChI=1S/C22H23N3O/c1-3-7-19(8-4-1)21-17-25(13-14-26-21)16-18-11-12-22(23-15-18)24-20-9-5-2-6-10-20/h1-12,15,21H,13-14,16-17H2,(H,23,24)/t21-/m1/s1
InChIKeyRPDZLBGRHMNTST-OAQYLSRUSA-N
MW345.45 g/mol
LogP4.40
Rot. Bonds5

About N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine

N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine (PubChem CID 24954444) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine
PubChem CID24954444
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC NameN-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine
SMILESc1ccc(Nc2ccc(CN3CCO[C@@H](c4ccccc4)C3)cn2)cc1
InChIInChI=1S/C22H23N3O/c1-3-7-19(8-4-1)21-17-25(13-14-26-21)16-18-11-12-22(23-15-18)24-20-9-5-2-6-10-20/h1-12,15,21H,13-14,16-17H2,(H,23,24)/t21-/m1/s1
InChIKeyRPDZLBGRHMNTST-OAQYLSRUSA-N
XLogP4.40
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

alpha-((2-Pyridinylamino)methyl)benzenemethanol
CID 9470
6-[(Benzyloxy)methyl]-5-{4-[(pyridin-4-ylmethyl)amino]phenyl}pyrimidine-2,4-diamine
CID 11327400
PF-592379
CID 10263487
N*2*-(2-Phenoxy-ethyl)-N*4*-((S)-1-phenyl-ethyl)-pyridine-2,4-diamine
CID 44393073
N*4*-(2-Phenoxy-ethyl)-N*2*-((S)-1-phenyl-ethyl)-pyridine-2,4-diamine
CID 44393192
1-[2-[bis(4-Fluorophenyl)methoxy]ethyl]-4-(pyridinyl)-piperazine
CID 4913097
Benzyl 4-[(pyridin-2-ylamino)methyl]piperidine-1-carboxylate
CID 10268204
2-(3-phenyl-3H-spiro[isobenzofuran-1,4''-piperidine]-1''-yl)pyridin-4-amine
CID 16730656
(16E)-19-methyl-14-oxa-5,7,19,27-tetrazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(24),2(27),3,5,8,10,12(26),16,21(25),22-decaene
CID 16739949
(16E)-14-methyl-19-oxa-5,7,14,23,27-pentazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(24),2(27),3,5,8,10,12(26),16,21(25),22-decaene
CID 16739951
(S)-N-(4-methoxyphenyl)-5-((2-phenylmorpholino)methyl)pyridin-2-amine
CID 24771838
(S)-N-(2-chlorophenyl)-5-((2-phenylmorpholino)methyl)pyridin-2-amine
CID 24954806

Frequently Asked Questions

What is the IUPAC name of N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine?
The IUPAC name of N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine (CID 24954444) is N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine.
What is the SMILES notation for N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine?
The canonical SMILES for N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine is c1ccc(Nc2ccc(CN3CCO[C@@H](c4ccccc4)C3)cn2)cc1.
What is the InChIKey of N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine?
The InChIKey is RPDZLBGRHMNTST-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H23N3O/c1-3-7-19(8-4-1)21-17-25(13-14-26-21)16-18-11-12-22(23-15-18)24-20-9-5-2-6-10-20/h1-12,15,21H,13-14,16-17H2,(H,23,24)/t21-/m1/s1.
What are the key properties of N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine?
N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine has a molecular weight of 345.45 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-5-[[(2S)-2-phenylmorpholin-4-yl]methyl]pyridin-2-amine is sourced from PubChem (CID 24954444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).