(2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide

C19H22N4O2 — CID 95308237

IUPAC(2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide
SMILESCCN(C)c1cc(CNC(=O)[C@@H](C)Oc2ccc(C#N)cc2)ccn1
InChIInChI=1S/C19H22N4O2/c1-4-23(3)18-11-16(9-10-21-18)13-22-19(24)14(2)25-17-7-5-15(12-20)6-8-17/h5-11,14H,4,13H2,1-3H3,(H,22,24)/t14-/m1/s1
InChIKeyOFJBUZOWVRHZEN-CQSZACIVSA-N
MW338.41 g/mol
LogP2.49
Rot. Bonds7

About (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide

(2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide (PubChem CID 95308237) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide
PubChem CID95308237
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name(2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide
SMILESCCN(C)c1cc(CNC(=O)[C@@H](C)Oc2ccc(C#N)cc2)ccn1
InChIInChI=1S/C19H22N4O2/c1-4-23(3)18-11-16(9-10-21-18)13-22-19(24)14(2)25-17-7-5-15(12-20)6-8-17/h5-11,14H,4,13H2,1-3H3,(H,22,24)/t14-/m1/s1
InChIKeyOFJBUZOWVRHZEN-CQSZACIVSA-N
XLogP2.49
TPSA78.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide with MolForge

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Related Compounds

2-(4-cyanophenoxy)-N-[[4-[(dimethylamino)methyl]phenyl]methyl]propanamide
CID 78810656
2-(4-cyanophenoxy)-N-[(4-propan-2-yloxyphenyl)methyl]propanamide
CID 134055001
2-(4-cyanophenoxy)-N-[(3-pyrazol-1-ylphenyl)methyl]propanamide
CID 56791885
(2S)-N-(1,3-benzodioxol-5-ylmethyl)-2-(4-cyanophenoxy)propanamide
CID 7858145
2-(4-cyanophenoxy)-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]propanamide
CID 55707900
5-[[2-(4-cyanophenoxy)propanoylamino]methyl]-2-methoxybenzoic acid
CID 45384516
2-(4-cyanophenoxy)-N-[[3-(furan-2-ylmethoxymethyl)phenyl]methyl]propanamide
CID 55660949
2-(4-cyanophenoxy)-N-[(2-methoxyphenyl)methyl]propanamide
CID 51143681
(2R)-2-(4-methylphenoxy)-N-[[2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]-4-pyridinyl]methyl]propanamide
CID 97352244
2-(4-cyanophenoxy)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide
CID 46464883
N-[3-[[[(2S)-2-(4-cyanophenoxy)propanoyl]amino]methyl]phenyl]cyclopropanecarboxamide
CID 25483945
2-(4-cyanophenoxy)-N-[2-(4-methylphenoxy)ethyl]propanamide
CID 51157171

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide?
The IUPAC name of (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide (CID 95308237) is (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide.
What is the SMILES notation for (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide?
The canonical SMILES for (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide is CCN(C)c1cc(CNC(=O)[C@@H](C)Oc2ccc(C#N)cc2)ccn1.
What is the InChIKey of (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide?
The InChIKey is OFJBUZOWVRHZEN-CQSZACIVSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-4-23(3)18-11-16(9-10-21-18)13-22-19(24)14(2)25-17-7-5-15(12-20)6-8-17/h5-11,14H,4,13H2,1-3H3,(H,22,24)/t14-/m1/s1.
What are the key properties of (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide?
(2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide has a molecular weight of 338.41 g/mol, XLogP of 2.49, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-cyanophenoxy)-N-[[2-[ethyl(methyl)amino]-4-pyridinyl]methyl]propanamide is sourced from PubChem (CID 95308237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).