(2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol

C19H31N3O2 — CID 124779951

IUPAC(2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol
SMILESCN(C[C@H](O)CN1CCOCC1)[C@H]1CCCN(c2ccccc2)C1
InChIInChI=1S/C19H31N3O2/c1-20(15-19(23)16-21-10-12-24-13-11-21)18-8-5-9-22(14-18)17-6-3-2-4-7-17/h2-4,6-7,18-19,23H,5,8-16H2,1H3/t18-,19-/m0/s1
InChIKeyOSXIZMQNKNNKEY-OALUTQOASA-N
MW333.48 g/mol
LogP1.28
Rot. Bonds6

About (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol

(2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol (PubChem CID 124779951) has the molecular formula C19H31N3O2 and a molecular weight of 333.48 g/mol. Its IUPAC name is (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol
PubChem CID124779951
Molecular FormulaC19H31N3O2
Molecular Weight333.48 g/mol
Exact Mass333.24
IUPAC Name(2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol
SMILESCN(C[C@H](O)CN1CCOCC1)[C@H]1CCCN(c2ccccc2)C1
InChIInChI=1S/C19H31N3O2/c1-20(15-19(23)16-21-10-12-24-13-11-21)18-8-5-9-22(14-18)17-6-3-2-4-7-17/h2-4,6-7,18-19,23H,5,8-16H2,1H3/t18-,19-/m0/s1
InChIKeyOSXIZMQNKNNKEY-OALUTQOASA-N
XLogP1.28
TPSA39.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-1-[methyl-[(3R)-1-phenylpiperidin-3-yl]amino]-3-pyrazol-1-ylpropan-2-ol
CID 96998183
(2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-pyrazol-1-ylpropan-2-ol
CID 124827378
1-[cyclopentyl(methyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 110882289
(2S)-1-[methyl-[(3R)-1-phenylpiperidin-3-yl]amino]-3-propan-2-yloxypropan-2-ol
CID 97018679
(3S)-N-(2-methoxyethyl)-N-methyl-1-phenylpiperidin-3-amine
CID 96567567
3-[2-[methyl-[(3R)-1-phenylpiperidin-3-yl]amino]ethyl]-1,3-oxazolidin-2-one
CID 97061273
4-[(2R)-2-(4-phenyl-1,4-diazepan-1-yl)propyl]morpholine
CID 129398102
(2R)-1-[2-[(3S)-3-methylpiperidin-1-yl]phenoxy]-3-morpholin-4-ylpropan-2-ol
CID 97243448
1-[benzyl(tert-butyl)amino]-3-morpholin-4-ylpropan-2-ol
CID 3742716
2-amino-N-methyl-4-methylsulfonyl-N-(1-phenylpiperidin-3-yl)butanamide
CID 119958110
3-ethyl-1-methyl-1-(1-phenylpiperidin-3-yl)urea
CID 136526166
1-[[2-(dimethylamino)phenyl]methyl-methylamino]-3-morpholin-4-ylpropan-2-ol
CID 111916375

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol?
The IUPAC name of (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol (CID 124779951) is (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol.
What is the SMILES notation for (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol?
The canonical SMILES for (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol is CN(C[C@H](O)CN1CCOCC1)[C@H]1CCCN(c2ccccc2)C1.
What is the InChIKey of (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol?
The InChIKey is OSXIZMQNKNNKEY-OALUTQOASA-N. The full InChI is InChI=1S/C19H31N3O2/c1-20(15-19(23)16-21-10-12-24-13-11-21)18-8-5-9-22(14-18)17-6-3-2-4-7-17/h2-4,6-7,18-19,23H,5,8-16H2,1H3/t18-,19-/m0/s1.
What are the key properties of (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol?
(2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol has a molecular weight of 333.48 g/mol, XLogP of 1.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[methyl-[(3S)-1-phenylpiperidin-3-yl]amino]-3-morpholin-4-ylpropan-2-ol is sourced from PubChem (CID 124779951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).