5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine

C19H25N3O — CID 11529694

IUPAC5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine
SMILESC[C@H]1CO[C@@H](c2ccc(N)nc2)CN1CCCc1ccccc1
InChIInChI=1S/C19H25N3O/c1-15-14-23-18(17-9-10-19(20)21-12-17)13-22(15)11-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,15,18H,5,8,11,13-14H2,1H3,(H2,20,21)/t15-,18+/m0/s1
InChIKeyBWGDAGTZIVIBHX-MAUKXSAKSA-N
MW311.43 g/mol
LogP3.06
Rot. Bonds5

About 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine

5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine (PubChem CID 11529694) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine
PubChem CID11529694
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC Name5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine
SMILESC[C@H]1CO[C@@H](c2ccc(N)nc2)CN1CCCc1ccccc1
InChIInChI=1S/C19H25N3O/c1-15-14-23-18(17-9-10-19(20)21-12-17)13-22(15)11-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,15,18H,5,8,11,13-14H2,1H3,(H2,20,21)/t15-,18+/m0/s1
InChIKeyBWGDAGTZIVIBHX-MAUKXSAKSA-N
XLogP3.06
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine?
The IUPAC name of 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine (CID 11529694) is 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine.
What is the SMILES notation for 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine?
The canonical SMILES for 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine is C[C@H]1CO[C@@H](c2ccc(N)nc2)CN1CCCc1ccccc1.
What is the InChIKey of 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine?
The InChIKey is BWGDAGTZIVIBHX-MAUKXSAKSA-N. The full InChI is InChI=1S/C19H25N3O/c1-15-14-23-18(17-9-10-19(20)21-12-17)13-22(15)11-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,15,18H,5,8,11,13-14H2,1H3,(H2,20,21)/t15-,18+/m0/s1.
What are the key properties of 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine?
5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine has a molecular weight of 311.43 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2S,5S)-5-methyl-4-(3-phenylpropyl)morpholin-2-yl]pyridin-2-amine is sourced from PubChem (CID 11529694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).