6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile

C19H22N4O — CID 97216224

IUPAC6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile
SMILESC[C@H](Nc1ccc(C#N)cn1)[C@H]1CN(Cc2ccccc2)CCO1
InChIInChI=1S/C19H22N4O/c1-15(22-19-8-7-17(11-20)12-21-19)18-14-23(9-10-24-18)13-16-5-3-2-4-6-16/h2-8,12,15,18H,9-10,13-14H2,1H3,(H,21,22)/t15-,18+/m0/s1
InChIKeyOBTDJGRLGAWVAX-MAUKXSAKSA-N
MW322.41 g/mol
LogP2.65
Rot. Bonds5

About 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile

6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile (PubChem CID 97216224) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile
PubChem CID97216224
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC Name6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile
SMILESC[C@H](Nc1ccc(C#N)cn1)[C@H]1CN(Cc2ccccc2)CCO1
InChIInChI=1S/C19H22N4O/c1-15(22-19-8-7-17(11-20)12-21-19)18-14-23(9-10-24-18)13-16-5-3-2-4-6-16/h2-8,12,15,18H,9-10,13-14H2,1H3,(H,21,22)/t15-,18+/m0/s1
InChIKeyOBTDJGRLGAWVAX-MAUKXSAKSA-N
XLogP2.65
TPSA61.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[1-(4-benzylmorpholin-2-yl)propylamino]pyridine-3-carbonitrile
CID 133364280
6-[1-(4-methylmorpholin-2-yl)ethylamino]pyridine-3-carbonitrile
CID 133386452
6-[(1-benzylpyrrolidin-3-yl)amino]pyridine-3-carbonitrile
CID 18133059
(1S)-1-[(2S)-4-benzylmorpholin-2-yl]ethanamine
CID 95396414
N-[(1S)-1-[(2S)-4-benzylmorpholin-2-yl]ethyl]-7H-purin-6-amine
CID 99810697
1-[[1-(4-benzylmorpholin-2-yl)ethylamino]methyl]cyclopentan-1-ol
CID 84587815
6-[2-(4-benzylpiperazin-1-yl)ethylamino]pyridine-3-carbonitrile
CID 35901850
(1R)-1-[(2R)-4-benzylmorpholin-2-yl]-N-(2-pyridin-2-ylethyl)ethanamine
CID 97229017
(1R)-1-[(2S)-4-benzylmorpholin-2-yl]-N-(2-pyridin-2-ylethyl)ethanamine
CID 97229015
N-[(1R)-1-[(2S)-4-benzylmorpholin-2-yl]ethyl]thiadiazole-5-carboxamide
CID 95981592
N-[(1R)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]-6-methylpyridine-3-carboxamide
CID 95775940
CID 89203711
CID 89203711

Frequently Asked Questions

What is the IUPAC name of 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile?
The IUPAC name of 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile (CID 97216224) is 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile?
The canonical SMILES for 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile is C[C@H](Nc1ccc(C#N)cn1)[C@H]1CN(Cc2ccccc2)CCO1.
What is the InChIKey of 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile?
The InChIKey is OBTDJGRLGAWVAX-MAUKXSAKSA-N. The full InChI is InChI=1S/C19H22N4O/c1-15(22-19-8-7-17(11-20)12-21-19)18-14-23(9-10-24-18)13-16-5-3-2-4-6-16/h2-8,12,15,18H,9-10,13-14H2,1H3,(H,21,22)/t15-,18+/m0/s1.
What are the key properties of 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile?
6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile has a molecular weight of 322.41 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(1S)-1-[(2R)-4-benzylmorpholin-2-yl]ethyl]amino]pyridine-3-carbonitrile is sourced from PubChem (CID 97216224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).